Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000534 (WOLTR: Wolbachia sp. subsp. Brugia malayi - Nov 2015)
Download : Data.csv | 3D Models

Tab legend : Full name of ligand selected in the comparative docking column: General color information : Quality: [ Good | Correct | Uncertain ]

Query		Structural Alignment (SA)		3D Modeling	Annotation	Ligands from PDB templates			Predicted Complexes - pKd:[ ‹nMol | ‹μMol | ‹mMol ]
	Query Sequence Filter:	Significants SA found	Seq Ident.	3D Core (QMean Score)	Classification code Uniprot Pfam Prosite Smart Cath ECNumber	Binding Site	Ligands Found (Procognate)	Profile	Complexes by comparative docking (ligands from PDB templates) ALL ADP - [nb=300] --> ADENOSINE-5'-DIPHOSPHATE NACID - [nb=228] --> 5'-D(P*TP*TP*T)-3' NAD - [nb=139] --> .....MIDE-ADENINE-DINUCLEOTIDE FAD - [nb=118] --> .....AVIN-ADENINE DINUCLEOTIDE CHAIN - [nb=108] --> DNA ATP - [nb=98] --> ADENOSINE-5'-TRIPHOSPHATE GDP - [nb=90] --> GUANOSINE-5'-DIPHOSPHATE PLP - [nb=89] --> PYRIDOXAL-5'-PHOSPHATE FMN - [nb=69] --> FLAVIN MONONUCLEOTIDE NDP - [nb=63] --> .....NE-DINUCLEOTIDE PHOSPHATE ANP - [nb=58] --> .....ONIC ACID-ADENYLATE ESTER AMP - [nb=54] --> ADENOSINE MONOPHOSPHATE NAP - [nb=53] --> .....NE-DINUCLEOTIDE PHOSPHATE HEM - [nb=42] --> .....ORPHYRIN IX CONTAINING FE SF4 - [nb=39] --> IRON/SULFUR CLUSTER CIT - [nb=39] --> CITRIC ACID GOL - [nb=37] --> GLYCEROL FMT - [nb=35] --> FORMIC ACID FES - [nb=35] --> .....E2/S2 (INORGANIC) CLUSTER COA - [nb=31] --> COENZYME A GNP - [nb=29] --> .....ONIC ACID-GUANYLATE ESTER AGS - [nb=25] --> .....ORIC ACID-ADENYLATE ESTER UMP - [nb=25] --> .....YURIDINE 5'-MONOPHOSPHATE UD1 - [nb=25] --> .....PHATE-N-ACETYLGLUCOSAMINE F3S - [nb=24] --> FE3-S4 CLUSTER EDO - [nb=24] --> 1,2-ETHANEDIOL CHD - [nb=22] --> CHOLIC ACID SAH - [nb=22] --> S-ADENOSYL-L-HOMOCYSTEINE C5P - [nb=22] --> CYTIDINE-5'-MONOPHOSPHATE PGA - [nb=21] --> 2-PHOSPHOGLYCOLIC ACID NAI - [nb=21] --> .....MIDE ADENINE DINUCLEOTIDE BB2 - [nb=18] --> ACTINONIN 2PG - [nb=17] --> 2-PHOSPHOGLYCERIC ACID DUP - [nb=17] --> .....A,BETA-IMIDO-TRIPHOSPHATE IMP - [nb=17] --> INOSINIC ACID SAM - [nb=17] --> S-ADENOSYLMETHIONINE PEP - [nb=17] --> PHOSPHOENOLPYRUVATE ACY - [nb=15] --> ACETIC ACID PNS - [nb=15] --> 4'-PHOSPHOPANTETHEINE 3PG - [nb=14] --> 3-PHOSPHOGLYCERIC ACID CTN - [nb=14] --> .....ANOSYL-2(1H)-PYRIMIDINONE U5P - [nb=14] --> URIDINE-5'-MONOPHOSPHATE POP - [nb=13] --> PYROPHOSPHATE 2- GLU - [nb=12] --> GLUTAMIC ACID AT4 - [nb=12] --> .....OOXY)PHOSPHORYL]ADENOSINE PGH - [nb=11] --> .....PHOGLYCOLOHYDROXAMIC ACID 5GP - [nb=11] --> .....UANOSINE-5'-MONOPHOSPHATE IPE - [nb=11] --> .....L TRIHYDROGEN DIPHOSPHATE HEC - [nb=11] --> HEME C ACP - [nb=10] --> .....ONIC ACID ADENYLATE ESTER KEU - [nb=10] --> .....]BENZOYL}-D-GLUTAMIC ACID 2PE - [nb=10] --> NONAETHYLENE GLYCOL DTP - [nb=10] --> .....ADENOSINE 5'-TRIPHOSPHATE GTP - [nb=9] --> GUANOSINE-5'-TRIPHOSPHATE GCP - [nb=9] --> .....ONIC ACID GUANYLATE ESTER NOV - [nb=9] --> NOVOBIOCIN 5RP - [nb=9] --> .....AR (RIBULOSE-5-PHOSPHATE) FLC - [nb=9] --> CITRATE ANION NLP - [nb=9] --> .....O-PENTYL)-PHOSPHONIC ACID ASP - [nb=8] --> ASPARTIC ACID TRS - [nb=8] --> .....XYMETHYL-PROPANE-1,3-DIOL DUD - [nb=8] --> .....OXYURIDINE-5'-DIPHOSPHATE SSA - [nb=8] --> .....ERYL)-SULFAMOYL)ADENOSINE YSA - [nb=8] --> .....ROSYL)SULFAMOYL]ADENOSINE SHF - [nb=7] --> LAEVULINIC ACID MET - [nb=7] --> METHIONINE DPM - [nb=7] --> .....RROL-3-YL}-PROPIONIC ACID GPP - [nb=7] --> GERANYL DIPHOSPHATE INI - [nb=7] --> .....,4(1H,3H)-PYRIMIDINEDIONE DU - [nb=7] --> .....YURIDINE-5'-MONOPHOSPHATE FOM - [nb=7] --> .....INO]PROPYLPHOSPHONIC ACID SFG - [nb=7] --> SINEFUNGIN GSH - [nb=7] --> GLUTATHIONE ICT - [nb=7] --> ISOCITRIC ACID UFP - [nb=6] --> .....YURIDINE-5'-MONOPHOSPHATE UDP - [nb=6] --> URIDINE-5'-DIPHOSPHATE TYD - [nb=6] --> THYMIDINE-5'-DIPHOSPHATE TYR - [nb=6] --> TYROSINE 1AA - [nb=6] --> .....}OXY)PHOSPHINATO]CYTIDINE 3P1 - [nb=6] --> .....-YLMETHYL)AMINO]ADENOSINE KT5 - [nb=6] --> .....MA-GLUTAMYL-GLUTAMIC ACID TMP - [nb=6] --> THYMIDINE-5'-PHOSPHATE CDP - [nb=6] --> CYTIDINE-5'-DIPHOSPHATE MTA - [nb=5] --> .....XY-5'-METHYLTHIOADENOSINE GAR - [nb=5] --> .....LYCINAMIDE RIBONUCLEOTIDE F6R - [nb=5] --> FRUCTOSE -6-PHOSPHATE 8OD - [nb=5] --> .....SPHONO HYDROGEN PHOSPHATE BMQ - [nb=5] --> .....FURANOSYL)BARBITURIC ACID PRF - [nb=5] --> .....AZA-7-AMINOMETHYL-GUANINE PIN - [nb=5] --> .....IS(2-ETHANESULFONIC ACID) E4P - [nb=5] --> ERYTHOSE-4-PHOSPHATE FPP - [nb=5] --> FARNESYL DIPHOSPHATE TRP - [nb=5] --> TRYPTOPHAN ADN - [nb=5] --> ADENOSINE RES - [nb=5] --> .....-ERYTHRONOHYDROXAMIC ACID RDL - [nb=5] --> .....5H-8-RIBITYLAMINOLUMAZINE GSP - [nb=5] --> .....OSPHATE-MONOTHIOPHOSPHATE RLP - [nb=5] --> .....ZINE-6-YL) PROPIONIC ACID I22 - [nb=5] --> .....-HEPT-2-ULOSE 7-PHOSPHATE SAP - [nb=5] --> .....OSPHATE MONOTHIOPHOSPHATE TLG - [nb=4] --> .....N-1-YL]THIOPHEN-2(5H)-ONE PAL - [nb=4] --> .....ONACETYL)-L-ASPARTIC ACID XAM - [nb=4] --> .....ETA-D-RIBO-HEXOPYRANOSIDE 9L9 - [nb=4] --> .....YLAMINO]PENTANEDIOIC ACID A3D - [nb=4] --> .....DINE ADENINE DINUCLEOTIDE CP - [nb=4] --> .....ACID MONO(FORMAMIDE)ESTER 39H - [nb=4] --> .....[B,D]FURAN-2-YL)ACETAMIDE XMP - [nb=4] --> .....NTHOSINE-5'-MONOPHOSPHATE 1A1 - [nb=4] --> .....L]CYCLOPROPANECARBOXAMIDE PPV - [nb=4] --> PYROPHOSPHATE TYM - [nb=4] --> TRYPTOPHANYL-5'AMP PAH - [nb=4] --> .....PHONOACETOHYDROXAMIC ACID PPS - [nb=4] --> .....SINE-5'-PHOSPHATE SULFATE CP3 - [nb=4] --> COPROPORPHYRIN III DPO - [nb=4] --> DIPHOSPHATE FDE - [nb=4] --> .....(III) DEUTEROPORPHYRIN IX AMO - [nb=4] --> .....DENOSINE-5'-MONOPHOSPHATE MPD - [nb=4] --> .....-2-METHYL-2,4-PENTANEDIOL B82 - [nb=4] --> .....RBONYL}AMINO)BENZOIC ACID PHE - [nb=4] --> PHENYLALANINE G6P - [nb=4] --> .....HA-D-GLUCOSE-6-PHOSPHATE) CKR - [nb=4] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE A2P - [nb=4] --> .....ENOSINE-2'-5'-DIPHOSPHATE 3FD - [nb=4] --> .....ETHOXYMETHYL]BENZONITRILE MKH - [nb=4] --> .....RIMIDINE-2,4(1H,3H)-DIONE C - [nb=4] --> CYTIDINE-5'-MONOPHOSPHATE G5A - [nb=4] --> .....GLYCYLSULFAMOYL)ADENOSINE LMS - [nb=4] --> .....-FURANYL]METHYL SULFAMATE BRU - [nb=4] --> .....YURIDINE-5'-MONOPHOSPHATE ADE - [nb=4] --> ADENINE 2CR - [nb=4] --> .....clopentanecarboxylic acid 1CP - [nb=4] --> COPROPORPHYRIN I RIS - [nb=3] --> .....IDENE BIS-PHOSPHONIC ACID DOO - [nb=3] --> .....IMIDO[4,5-B]INDOL-8-AMINE 535 - [nb=3] --> .....,3]THIAZOLE-2-CARBOXYLATE FFT - [nb=3] --> .....1-YL DIHYDROGEN PHOSPHATE GLP - [nb=3] --> .....(GLUCOSAMINE 6-PHOSPHATE) MNT - [nb=3] --> .....-ADENOSINE-5'-DIPHOSPHATE SB7 - [nb=3] --> .....ENYLPROPYL)AMINO]METHANOL FPS - [nb=3] --> .....IHYDROGEN THIODIPHOSPHATE B29 - [nb=3] --> .....NO-ETHYL]-PHOSPHONIC ACID A3P - [nb=3] --> .....ENOSINE-3'-5'-DIPHOSPHATE CMP - [nb=3] --> .....',5'-CYCLIC-MONOPHOSPHATE BB1 - [nb=3] --> .....,2-DIMETHYL-PROPYL)-AMIDE LEU - [nb=3] --> LEUCINE TBD - [nb=3] --> .....O DIPHOSPHATE (ISOMER RP) R52 - [nb=3] --> 5-O-PHOSPHONO-D-RIBOSE P6G - [nb=3] --> HEXAETHYLENE GLYCOL 3AN - [nb=3] --> ..... ADENOSINE-5'-DIPHOSPHATE Q21 - [nb=3] --> .....NZOXAZOL-5-YL]PROPANAMIDE G2P - [nb=3] --> .....ONIC ACID GUANYLATE ESTER AO9 - [nb=3] --> .....YLCARBONYL)AMINO]CYTIDINE BRR - [nb=3] --> .....MINO]METHYL}HEXANOIC ACID LGP - [nb=3] --> .....-GUANINE-3'-MONOPHOSPHATE P00 - [nb=3] --> .....NEAMINO]OXY-BUTANOIC ACID PUL - [nb=3] --> .....-BETA-L-GALACTOPYRANOSIDE F98 - [nb=3] --> .....INO]PROPYLPHOSPHONIC ACID 5SP - [nb=3] --> .....AR (RIBULOSE-5-PHOSPHATE) MLC - [nb=3] --> MALONYL-COENZYME A B08 - [nb=3] --> .....YL-ETHYL)-PHOSPHONIC ACID GSU - [nb=3] --> .....AMYL-SULFAMOYL)-ADENOSINE GLY - [nb=3] --> GLYCINE FUM - [nb=3] --> FUMARIC ACID HEA - [nb=3] --> HEME-A GRG - [nb=3] --> .....ERANYLGERANYL DIPHOSPHATE I5A - [nb=3] --> 5'-DEOXY-5'-IODOCYTIDINE G1P - [nb=3] --> .....HA-D-GLUCOSE-1-PHOSPHATE) DOR - [nb=3] --> .....IMIDINE-4-CARBOXYLIC ACID F01 - [nb=3] --> .....-5-FLUORO-PYRIMIDIN-2-ONE 0O2 - [nb=3] --> .....(TRIHYDROGEN DIPHOSPHATE) RS3 - [nb=3] --> .....IDIN-10(2H)-YL]-D-RIBITOL PP9 - [nb=3] --> PROTOPORPHYRIN IX 2BJ - [nb=3] --> .....MOYL}-4-NITROBENZOIC ACID LA8 - [nb=3] --> .....-ADENOSINE-5'-DIPHOSPHATE J47 - [nb=2] --> .....DROXYPHENOXY)BENZONITRILE DAL - [nb=2] --> D-ALANINE NDE - [nb=2] --> .....OSYLPYRIDINIUM INNER SALT TSB - [nb=2] --> .....ONYL)-SULFAMOYL)ADENOSINE G5P - [nb=2] --> .....-GUANOSYL) PENTAPHOSPHATE 717 - [nb=2] --> .....[1,3]THIAZOL-6-YLMETHANOL LSX - [nb=2] --> .....-OXOBUTYL]PHOSPHONIC ACID KT3 - [nb=2] --> .....MA-GLUTAMYL-GLUTAMIC ACID 3BH - [nb=2] --> .....XYMETHYL)OXOLANE-3,4-DIOL TUI - [nb=2] --> .....-4-YL)PHENOXY)ACETIC ACID PDC - [nb=2] --> .....INE-2,6-DICARBOXYLIC ACID 2WU - [nb=2] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE FBP - [nb=2] --> FRUCTOSE-1,6-DIPHOSPHATE 3BK - [nb=2] --> .....XYMETHYL)OXOLANE-3,4-DIOL FCD - [nb=2] --> .....L)FURAN-2-CARBOXYLIC ACID IPR - [nb=2] --> ISOPENTYL PYROPHOSPHATE 2VF - [nb=2] --> .....RBAZOLE-2-CARBOXYLIC ACID 2BO - [nb=2] --> .....-4-yl}methyl)-L-threonine 3B9 - [nb=2] --> .....ROPYL]-4-PHENOXYBENZAMIDE IB3 - [nb=2] --> .....-OXOBUTYL]PHOSPHONIC ACID DCP - [nb=2] --> .....YCYTIDINE-5'-TRIPHOSPHATE YE6 - [nb=2] --> .....YL)FURAN-2-CARBOHYDRAZIDE RF7 - [nb=2] --> .....enylbutyl}phosphonic acid FYA - [nb=2] --> .....PHENYLALANINOL-PHOSPHATE] DOI - [nb=2] --> .....-(PHOSPHONOOXY)-9H-PURINE AGI - [nb=2] --> .....YPHENYL)-4H-CHROMEN-4-ONE 48S - [nb=2] --> .....-oxobutyl]phosphonic acid AIQ - [nb=2] --> .....HYL)-3H-QUINAZOLINE-4-ONE FFO - [nb=2] --> .....)BENZOYL]-L-GLUTAMIC ACID UMA - [nb=2] --> .....-ACETYLMURAMOYL-L-ALANINE C2R - [nb=2] --> .....IDAZOLE-4-CARBOXYLIC ACID L34 - [nb=2] --> .....NYLCARBONYL-GLUTAMIC ACID 1B3 - [nb=2] --> .....SULFONYL}-L-THREONINAMIDE 0CH - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE B28 - [nb=2] --> .....YL-ETHYL)-PHOSPHONIC ACID 40B - [nb=2] --> [HYDROXY(1,1' BTN - [nb=2] --> BIOTIN A5A - [nb=2] --> .....ANYL)-SULFAMOYL)ADENOSINE IDN - [nb=2] --> .....THYRIDIN-3-YL)-ACRYLAMIDE AFI - [nb=2] --> .....DROXY-1(2H)-NAPHTHALENONE PMA - [nb=2] --> PYROMELLITIC ACID DXP - [nb=2] --> .....Y-D-XYLULOSE-5-PHOSPHATE) RPL - [nb=2] --> .....HYDANTOCIDIN 5'-PHOSPHATE 0CM - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE CTP - [nb=2] --> CYTIDINE-5'-TRIPHOSPHATE 3GO - [nb=2] --> .....ETHOXYMETHYL]BENZONITRILE SER - [nb=2] --> SERINE FM5 - [nb=2] --> .....NYL)PROPYLPHOSPHONIC ACID UTP - [nb=2] --> URIDINE 5'-TRIPHOSPHATE 2VM - [nb=2] --> .....RBAZOLE-2-CARBOXYLIC ACID R77 - [nb=2] --> .....enylhexyl]phosphonic acid DS0 - [nb=2] --> .....-YL] DIHYDROGEN PHOSPHATE G6Q - [nb=2] --> .....GAR (GLUCOSE-6-PHOSPHATE) GNR - [nb=2] --> .....-2-YL)-N-HYDROXYACETAMIDE TLH - [nb=2] --> .....L)ETHANOYL]THIOPHEN-2-ONE G3P - [nb=2] --> SN-GLYCEROL-3-PHOSPHATE 1B2 - [nb=2] --> .....SULFONYL}-L-THREONINAMIDE 21X - [nb=2] --> .....]PYRIMIDINE-5-CARBOXAMIDE FON - [nb=2] --> FOLINIC ACID PMN - [nb=2] --> PLATENSIMYCIN 2RA - [nb=2] --> 3-AMINO-D-ALANINE C0K - [nb=2] --> .....-OXOBUTYL}PHOSPHONIC ACID G4P - [nb=2] --> .....SINE-5',3'-TETRAPHOSPHATE PCP - [nb=2] --> .....TANE-METHANOL-5-PHOSPHATE COH - [nb=2] --> .....ORPHYRIN IX CONTAINING CO CYS - [nb=2] --> CYSTEINE ME8 - [nb=2] --> .....-METHYLSULFANYL-BUTANOATE PLG - [nb=2] --> .....HYL-PYRIDIN-4-YL-METHANE] IMD - [nb=2] --> IMIDAZOLE AIR - [nb=2] --> .....OIMIDAZOLE RIBONUCLEOTIDE 21W - [nb=2] --> .....]PYRIMIDINE-5-CARBOXAMIDE TZN - [nb=2] --> .....HYDROFURAN-2-YL]METHANONE CBQ - [nb=2] --> .....O-METHYL]-PHOSPHONIC ACID U12 - [nb=2] --> .....AZO)-5H-PYRAZOL-3-YLAMINE PYR - [nb=2] --> PYRUVIC ACID FM6 - [nb=2] --> .....NO]PROPYL]PHOSPHONIC ACID MAP - [nb=2] --> .....DENYLY-IMIDO-TRIPHOSPHATE 0K2 - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE FOB - [nb=2] --> .....YL)PROPYL]PHOSPHONIC ACID 322 - [nb=2] --> .....AZOLIDIN-3-YL]ACETIC ACID COD - [nb=2] --> DEPHOSPHO COENZYME A G16 - [nb=2] --> .....GLUCOSE 1,6-BISPHOSPHATE) ALO - [nb=2] --> ALLO-THREONINE 191 - [nb=2] --> PROPIONYL COENZYME A MLN - [nb=2] --> .....L-L-LEUCYL-P-NITROANILIDE CAR - [nb=2] --> .....NE ARABINOSE-5'-PHOSPHATE P5A - [nb=2] --> .....OLYL)-SULFAMOYL)ADENOSINE PBG - [nb=2] --> .....YRROL-3-YL]PROPANOIC ACID GAX - [nb=2] --> .....-3-(1,3-THIAZOL-2-YL)UREA BDE - [nb=2] --> .....THYLENE]NICOTINOHYDRAZIDE C2E - [nb=2] --> .....AHYDRO-2H,7H-DIFURO[3,2-D 5CA - [nb=2] --> .....INYL)-SULFAMOYL)ADENOSINE 2RB - [nb=2] --> .....]-4-METHOXYBENZOHYDRAZIDE SM8 - [nb=2] --> SIMOCYCLINONE D8 2E7 - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE Q02 - [nb=2] --> .....yl)methyl]phosphonic acid RLI - [nb=2] --> .....L-2-YL]AMINO}BENZOIC ACID IKY - [nb=2] --> .....1,3-OXAZOLE-4-CARBOXAMIDE 2EY - [nb=2] --> .....ETHOXY}QUINOLIN-2(1H)-ONE 2VG - [nb=2] --> .....RBAZOLE-2-CARBOXYLIC ACID 11C - [nb=2] --> .....)-2-AMINOHEXANEDIOIC ACID CDM - [nb=2] --> .....L-2-C-METHYL-D-ERYTHRITOL Q08 - [nb=2] --> .....pylpentyl]phosphonic acid 829 - [nb=2] --> .....YLCARBONYL)AMINO]CYTIDINE 1X9 - [nb=2] --> CERULENIN UDT - [nb=2] --> .....YL HYDROGEN THIOCARBONATE 4BB - [nb=2] --> .....ETHYLIDENE]BENZOHYDRAZIDE A - [nb=2] --> .....DENOSINE-5'-MONOPHOSPHATE IMB - [nb=2] --> .....O-METHYL]-PHOSPHONIC ACID QUE - [nb=2] --> .....3',4'-PENTAHYDROXYFLAVONE 3F5 - [nb=2] --> .....-8-(METHYLAMINO)ADENOSINE DCT - [nb=2] --> .....YCYTIDINE 5'-TRIPHOSPHATE 3JL - [nb=2] --> .....ENE-1,2-DICARBOXYLIC ACID VZZ - [nb=2] --> .....BONYL)OXY]UNDECANOIC ACID 2E5 - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE RC5 - [nb=2] --> .....nylpentyl]phosphonic acid FMR - [nb=2] --> FUMARATE FDA - [nb=2] --> .....VINE-ADENINE DINUCLEOTIDE CT0 - [nb=2] --> .....2-(THIAZOL-2-YL)OXALAMIDE AGP - [nb=2] --> .....MINO GLUCITOL-6-PHOSPHATE DAO - [nb=2] --> LAURIC ACID Y10 - [nb=2] --> .....MIDE (NON-PREFERRED NAME) DCN - [nb=2] --> DICLOSAN PMP - [nb=2] --> .....INOPYRIDOXAL-5'-PHOSPHATE PHY - [nb=2] --> .....HOSPHORYL-PHOSPHINIC ACID 1XG - [nb=2] --> .....-OXODODECA-7,10-DIENAMIDE X16 - [nb=2] --> .....SULFONYL}-L-THREONINAMIDE 2VD - [nb=2] --> .....RBAZOLE-2-CARBOXYLIC ACID Q07 - [nb=2] --> .....hylpentyl]phosphonic acid HHV - [nb=2] --> .....1H-PYRAZOLE-4-CARBOXAMIDE NAJ - [nb=2] --> .....INUCLEOTIDE (ACIDIC FORM) LMR - [nb=2] --> .....2-HYDROXYBUTANEDIOIC ACID 4PS - [nb=2] --> 4'-DIPHOSPHO PANTETHEINE TLA - [nb=2] --> L(+)-TARTARIC ACID 25A - [nb=2] --> .....ONOPHOSPHORYLADENYLYL(2'- B75 - [nb=2] --> .....NE-1,1-BISPHOSPHONIC ACID ACE - [nb=2] --> ACETYL GROUP 4NO - [nb=2] --> .....O-2-PHOSPHONOBENZOIC ACID 2BE - [nb=2] --> .....ETHYLIDENE]BENZOHYDRAZIDE 743 - [nb=2] --> .....XOCYCLOHEXANECARBONITRILE 2V6 - [nb=2] --> .....O[1,5-A]PYRIMIDIN-7-AMINE OCA - [nb=2] --> .....NOIC ACID (CAPRYLIC ACID) ENX - [nb=2] --> ENACYLOXIN IIA DG3 - [nb=2] --> .....GUANOSINE-5'-TRIPHOSPHATE T3P - [nb=2] --> THYMIDINE-3'-PHOSPHATE ZDP - [nb=2] --> .....2-METHYLHEPTANEDIOIC ACID EPU - [nb=2] --> .....LUCOSAMINYL) BUTYRIC ACID R5P - [nb=2] --> .....UGAR (RIBOSE-5-PHOSPHATE) 0O3 - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE 2BB - [nb=2] --> .....ETHYLPROPYL)BUTANEDIAMIDE DDS - [nb=2] --> .....OXYADENOSINE TRIPHOSPHATE ABM - [nb=2] --> .....ONIC ACID ADENOSINE ESTER 34F - [nb=2] --> .....NO]PROPYL}PHOSPHONIC ACID 409 - [nb=2] --> .....SULFONYL}-L-THREONINAMIDE BIH - [nb=2] --> .....ALENE-2,6-DISULFONIC ACID CRM - [nb=2] --> .....RIDIN-6-YL]PROPANOIC ACID 0CG - [nb=2] --> .....L TRIHYDROGEN DIPHOSPHATE PRO - [nb=1] --> PROLINE H5P - [nb=1] --> HYDANTOCIDIN-5'-PHOSPHATE H6P - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE IVH - [nb=1] --> .....-(BUTYLSULFANYL)ADENOSINE Y16 - [nb=1] --> .....IS(OXIDANYL)NON-6-ENAMIDE MRC - [nb=1] --> MUPIROCIN ZED - [nb=1] --> .....OPYL]-4-(PHENYLTHIO)-, 4S 2LG - [nb=1] --> .....IETHYLSULFAMOYL-BENZAMIDE 62D - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE CBN - [nb=1] --> CLOROBIOCIN NIA - [nb=1] --> .....THYL DIHYDROGEN PHOSPHATE CJH - [nb=1] --> .....L)-3-HYDROXYBUT-2-ENAMIDE ILA - [nb=1] --> .....-[ADENOSYL]-DIAMINOSUFONE ICA - [nb=1] --> .....SOCITRATE CALCIUM COMPLEX 4OX - [nb=1] --> 4-OXODECANEDIOIC ACID AAQ - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE TFD - [nb=1] --> .....N-2-YL]ETHANE-1,2-DIAMINE LYS - [nb=1] --> LYSINE U14 - [nb=1] --> .....ZOL-4-YLAZO)-BENZOIC ACID THR - [nb=1] --> THREONINE 2BC - [nb=1] --> .....HTHALENE-2-CARBOHYDRAZIDE B46 - [nb=1] --> .....ZOL-3-YL]METHYL}CARBAMATE 0XS - [nb=1] --> .....PHTHYRIDINE-3-CARBOXAMIDE U15 - [nb=1] --> .....OYL]-D-ALANYL-D-LEUCINATE 2EJ - [nb=1] --> .....OPYL}-3-THIOPHEN-3-YLUREA AP2 - [nb=1] --> .....HONIC ACID ADENOSYL ESTER M1P - [nb=1] --> .....R (D-MANNOSE 1-PHOSPHATE) M6P - [nb=1] --> .....PHA-D-MANNOSE-6-PHOSPHATE 1PN - [nb=1] --> .....ENEM-3-CARBOXYLATEPROPANE TBU - [nb=1] --> TERTIARY-BUTYL ALCOHOL URI - [nb=1] --> URIDINE XSP - [nb=1] --> .....OSPHONOOXY)PROPANOIC ACID CDF - [nb=1] --> CYTIDINE-5'-DIPHOSPHATE FZ1 - [nb=1] --> .....(PYRIDIN-2-YL)QUINAZOLINE 2SA - [nb=1] --> .....-6-YLAMINO]-SUCCINIC ACID ATF - [nb=1] --> .....ONIC ACID-ADENYLATE ESTER POI - [nb=1] --> .....-4-YL}METHYL)-L-ORNITHINE NPI - [nb=1] --> 2-AMINOPIMELIC ACID 545 - [nb=1] --> .....- ACETIC ACID BUTYL ESTER MAQ - [nb=1] --> .....ETHYLQUINAZOLIN-4(3H)-ONE DUT - [nb=1] --> .....XYURIDINE-5'-TRIPHOSPHATE 12T - [nb=1] --> .....ENE-1,4-DICARBOXYLIC ACID 0EX - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE 344 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE FUP - [nb=1] --> .....-URIDIDINE-5'-DIPHOSPHATE 7RD - [nb=1] --> .....N-1-YL)THIOPHEN-2(5H)-ONE 22L - [nb=1] --> .....2,3-D]PYRIMIDIN-4(3H)-ONE MFX - [nb=1] --> .....INOLINE-3-CARBOXYLIC ACID 0N5 - [nb=1] --> .....YL)AMINO]PHENYL}BENZAMIDE PML - [nb=1] --> PIMELIC ACID FLQ - [nb=1] --> .....'-XANTHENE]-6-CARBOXAMIDE 3JM - [nb=1] --> .....ENE-1,2-DICARBOXYLIC ACID 0V5 - [nb=1] --> .....OSPHONOOXY)PROPANOIC ACID AYM - [nb=1] --> .....OL-2-YL)METHYL]ACRYLAMIDE FEO - [nb=1] --> MU-OXO-DIIRON A12 - [nb=1] --> .....HONIC ACID ADENOSYL ESTER 629 - [nb=1] --> .....ERIDIN-2-YL)- ACETIC ACID 0V2 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE U11 - [nb=1] --> .....PROPANOYL}ALANYLGLYCINATE AKG - [nb=1] --> 2-OXOGLUTARIC ACID NDO - [nb=1] --> .....E)-DINUCLEOTIDE PHOSPHATE AE6 - [nb=1] --> .....,8-NAPHTHYRIDIN-2(1H)-ONE 0WY - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE APC - [nb=1] --> .....HONIC ACID ADENOSYL ESTER DMA - [nb=1] --> DIMETHYLALLYL DIPHOSPHATE PK3 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE MF3 - [nb=1] --> .....THYLSULFANYL-BUTYRIC ACID A04 - [nb=1] --> .....OXY)PHENYL]-2-FUROIC ACID 3JN - [nb=1] --> .....ENE-1,2-DICARBOXYLIC ACID 4BE - [nb=1] --> .....ETHYLIDENE]BENZOHYDRAZIDE PK2 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE GN1 - [nb=1] --> .....NO-ALPHA-D-GLUCOPYRANOSE) PPE - [nb=1] --> .....PHONOOXYMETHYL-PYRIDINIUM 2MQ - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE L5Y - [nb=1] --> .....YRIDIN-4-YL]AMINO}ETHANOL 4FC - [nb=1] --> .....IPHENYL-4-CARBOXYLIC ACID 5C1 - [nb=1] --> .....1,3-OXAZOLE-2-CARBOXAMIDE 1AY - [nb=1] --> .....O)ETHYL)PYRIMIDIN-4-AMINE IPA - [nb=1] --> ISOPROPYL ALCOHOL MPH - [nb=1] --> .....L-PROPYL)-PHOSPHONIC ACID 0RA - [nb=1] --> .....-YL)PHENYL]PROPANOIC ACID 2B7 - [nb=1] --> .....-YL]-3-PROP-2-EN-1-YLUREA HJ3 - [nb=1] --> .....OLIDINE-4-CARBOXYLIC ACID MPJ - [nb=1] --> .....L-PROPYL)-PHOSPHINIC ACID 1UQ - [nb=1] --> .....YL)METHYL]PHOSPHONIC ACID TPP - [nb=1] --> THIAMINE DIPHOSPHATE 3BJ - [nb=1] --> .....,3,5-TRIAZINE-2,4-DIAMINE 3BD - [nb=1] --> .....]PYRIMIDINE-6-CARBOXAMIDE 0L6 - [nb=1] --> .....TRAHYDROGEN TRIPHOSPHATE) 7NP - [nb=1] --> .....hydronaphthalen-1(2H)-one UVW - [nb=1] --> ACETYLPHOSPHATE MRD - [nb=1] --> .....-2-METHYLPENTANE-2,4-DIOL GUN - [nb=1] --> GUANINE LZS - [nb=1] --> .....RIFLUOROETHANESULFONAMIDE 1SF - [nb=1] --> .....RIMIDINE-2,4(1H,3H)-DIONE B23 - [nb=1] --> .....ITROPHENYL)-2-FUROIC ACID TET - [nb=1] --> .....OSPHONOOXY)PROPIONIC ACID 2HU - [nb=1] --> 5-NITRO-1H-INDOLE ALA - [nb=1] --> ALANINE SHO - [nb=1] --> 5-HYDROXYLAEVULINIC ACID B76 - [nb=1] --> [1-HYDROXY-2-(1,1' C8E - [nb=1] --> .....YLOXY)TRI(ETHYLOXY)OCTANE T07 - [nb=1] --> .....-4H-1,2,4-TRIAZOL-3-AMINE YE7 - [nb=1] --> .....UINOLINE-2-CARBOHYDRAZIDE 0CN - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE DPR - [nb=1] --> D-PROLINE A18 - [nb=1] --> .....LOROBENZYL)-2-FUROIC ACID 138 - [nb=1] --> .....-PROPANYLAMINO]-ACETAMIDE 4S4 - [nb=1] --> .....nyl]amino}benzoyl)glycine 28G - [nb=1] --> .....-YL}-3-PROP-2-EN-1-YLUREA Y08 - [nb=1] --> .....IS(OXIDANYL)NON-6-ENAMIDE 2J2 - [nb=1] --> .....RBAZOLE-1-CARBOXYLIC ACID 18W - [nb=1] --> .....YRROL-3-YL]PROPANOIC ACID COZ - [nb=1] --> COENZYME A SCB - [nb=1] --> .....HYL}-2-FURYL)BENZOIC ACID 2E4 - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE X1P - [nb=1] --> .....HONO-ALPHA-D-XYLOPYRANOSE 28F - [nb=1] --> .....O[5,4-B]PYRIDIN-2-YL}UREA KIR - [nb=1] --> KIRROMYCIN 0EV - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE 0WE - [nb=1] --> .....THYRIDIN-3-YL)PROPANAMIDE 6NA - [nb=1] --> HEXANOIC ACID R1P - [nb=1] --> .....UGAR (RIBOSE-1-PHOSPHATE) OYA - [nb=1] --> OCTANAL 1X8 - [nb=1] --> .....YRIDINE-2,7-DICARBOXAMIDE SAK - [nb=1] --> .....-DIHYDRO-4H-CHROMEN-4-ONE APR - [nb=1] --> .....ENOSINE-5-DIPHOSPHORIBOSE NVG - [nb=1] --> .....NOSYL)PYRIMIDIN-2(1H)-ONE DAV - [nb=1] --> DELTA-AMINO VALERIC ACID TYA - [nb=1] --> .....ESTER ADENOSIN-5'YL ESTER 27O - [nb=1] --> .....HALEN-1-YL)PROPANOIC ACID NIC - [nb=1] --> NITROISOCITRIC ACID 26P - [nb=1] --> 2-AMINO-6-OXOPIMELIC ACID 3PY - [nb=1] --> 3-HYDROXYPYRUVIC ACID TAP - [nb=1] --> .....NE-DINUCLEOTIDE PHOSPHATE L5V - [nb=1] --> .....2,4-TRIAZOL-3-YL)PYRAZINE 129 - [nb=1] --> .....O)-ETHYL]-PHOSPHONIC ACID IYR - [nb=1] --> 3-IODO-TYROSINE LZK - [nb=1] --> .....-D]PYRIMIDINE-2,7-DIAMINE 0L4 - [nb=1] --> .....O[2,3-D]PYRIMIDIN-4-AMINE Q04 - [nb=1] --> .....exylethyl]phosphonic acid BCE - [nb=1] --> .....NO-3-HYDROXYBUT-2-ENAMIDE 654 - [nb=1] --> .....ETHYLBENZYL)-1H-IMIDAZOLE SON - [nb=1] --> .....SINE PHOSPHONOACETIC ACID FA5 - [nb=1] --> .....PHENYLALANINYL-PHOSPHATE] U17 - [nb=1] --> .....NOYL]-L-SERYL-L-LEUCINATE TFV - [nb=1] --> .....N-2-YL]ETHANE-1,2-DIAMINE DQB - [nb=1] --> .....NZOYL)AMINO]BUTANOIC ACID Y7Y - [nb=1] --> .....D]IMIDAZOLE-1-CARBOXYLATE SFK - [nb=1] --> .....ENTANOYL)-L-PHENYLALANINE 2E6 - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE TLM - [nb=1] --> THIOLACTOMYCIN L24 - [nb=1] --> .....L]-CARBONYL-GLUTAMIC ACID 1YP - [nb=1] --> .....-3,3'-BIPYRIDIN-6-YL}UREA 0WX - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE FM8 - [nb=1] --> .....NO}PROPYL]PHOSPHONIC ACID 2GN - [nb=1] --> .....PHOLINOSULFONYL)BENZAMIDE QEI - [nb=1] --> .....OLO[2,3-D]PYRIMIDIN-4-ONE 5AL - [nb=1] --> .....ROXY)PHOSPHORYL]ADENOSINE IMJ - [nb=1] --> .....RIDIN-3-YL)PROP-2-ENAMIDE HM4 - [nb=1] --> .....YL]PYRIDIN-3-YL}CARBAMATE TMG - [nb=1] --> .....OL-4-YL)-1H-BENZIMIDAZOLE IGM - [nb=1] --> .....IN-4-YLSULFONYL-BENZAMIDE DCV - [nb=1] --> .....YL)PROPYL]PHOSPHONIC ACID MTY - [nb=1] --> META-TYROSINE Q06 - [nb=1] --> .....tylpropyl]phosphonic acid 840 - [nb=1] --> PLATENSIMYCIN A1 5AS - [nb=1] --> .....ETHYL-SULFAMOYL)ADENOSINE KAH - [nb=1] --> .....NO-4-HYDROXYHEXANOIC ACID GPX - [nb=1] --> .....ANOSINE 5'-DIPHOSPHATE 2' PLU - [nb=1] --> LEUCINE PHOSPHONIC ACID 2HQ - [nb=1] --> .....HLORO-1H-INDOLE-2,3-DIONE RVP - [nb=1] --> RIBAVIRIN MONOPHOSPHATE 27R - [nb=1] --> .....ENZOYL)PHENYL]ACETIC ACID ACO - [nb=1] --> ACETYL COENZYME *A MSJ - [nb=1] --> .....N-2-YL}BENZENESULFONAMIDE UQ2 - [nb=1] --> UBIQUINONE-2 AEK - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE ASN - [nb=1] --> ASPARAGINE Y02 - [nb=1] --> .....MIDE (NON-PREFERRED NAME) TP6 - [nb=1] --> .....ETRIONE-7-YL) 1-PHOSPHATE 1LG - [nb=1] --> .....INE-4-SULFONYL)-BENZAMIDE QMS - [nb=1] --> .....N-8-YL)METHANESULFONAMIDE HAD - [nb=1] --> .....YDROXYAMINO)ETHANOIC ACID 4JG - [nb=1] --> .....1,3-THIAZOL-5-YL]ETHANONE 0KL - [nb=1] --> .....TRAHYDROGEN TRIPHOSPHATE) CFX - [nb=1] --> CEFOXITIN 485 - [nb=1] --> .....-PYRAN-2-YL)- ACETIC ACID 0R6 - [nb=1] --> .....TRAHYDROGEN TRIPHOSPHATE) W29 - [nb=1] --> .....HEN-2-YL)BENZENE-1,2-DIOL TH9 - [nb=1] --> .....OXY-4-OXOBUT-2-ENOIC ACID T03 - [nb=1] --> .....LFANYL]-4H-1,2,4-TRIAZOLE HXZ - [nb=1] --> .....TRAHYDROGEN TRIPHOSPHATE) CER - [nb=1] --> .....ANS,TRANS-DODECADIENAMIDE RB5 - [nb=1] --> SUGAR (D-XYLITOL) 1S8 - [nb=1] --> .....YL)AMINO]PHENYL}BENZAMIDE 6NI - [nb=1] --> 6-NITROINDAZOLE AOS - [nb=1] --> SUGAR (D-ALLOSE) 0R7 - [nb=1] --> .....SPHONO HYDROGEN PHOSPHATE EMO - [nb=1] --> .....8-TRIHYDROXYANTHRAQUINONE 0JX - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE P9A - [nb=1] --> .....2,4-DIHYDROXYBENZOIC ACID FC3 - [nb=1] --> .....HYL)PHENYL]-2-FUROIC ACID 3GQ - [nb=1] --> .....-1,2,3-TRICARBOXYLIC ACID 10G - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE FOU - [nb=1] --> .....RIMIDINE-2,4(1H,3H)-DIONE GVS - [nb=1] --> .....H)-YL]OXETAN-3-YL}ACETATE BHB - [nb=1] --> .....THYL)-3H-QUINAZOLIN-4-ONE SCA - [nb=1] --> SUCCINYL-COENZYME A N32 - [nb=1] --> .....X-1-ENE-1-CARBOXYLIC ACID A05 - [nb=1] --> .....ITROPHENYL)-2-FUROIC ACID SCO - [nb=1] --> SUCCINAMIDE-COA FC2 - [nb=1] --> .....LOROPHENYL)-2-FUROIC ACID 10E - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE DXY - [nb=1] --> .....CARBONYL)-L-GLUTAMIC ACID H78 - [nb=1] --> .....ONO-ETHYL]PHOSPHONIC ACID 0L5 - [nb=1] --> .....TRAHYDROGEN TRIPHOSPHATE) GLN - [nb=1] --> GLUTAMINE U13 - [nb=1] --> .....MINO-5H-PYRAZOL-3-YLAMINE B21 - [nb=1] --> .....HOXYPHENYL)-2-FUROIC ACID 200 - [nb=1] --> 4-CHLORO-L-PHENYLALANINE A26 - [nb=1] --> .....THYL)PHENYL]BUT-2-ENAMIDE 1X7 - [nb=1] --> .....-C]PYRIDINE-7-CARBOXAMIDE DSB - [nb=1] --> 4,7-DIOXOSEBACIC ACID FCN - [nb=1] --> FOSFOMYCIN U16 - [nb=1] --> .....OYL]-D-ALANYL-D-LEUCINATE NVC - [nb=1] --> .....HEXYL]-N-HYDROXYFORMAMIDE BO9 - [nb=1] --> .....OXY)CARBONYL-L-LYSINAMIDE MIC - [nb=1] --> .....LPHA-METHYLISOCITRIC ACID PEG - [nb=1] --> DI(HYDROXYETHYL)ETHER 3NP - [nb=1] --> 3-NITROPROPANOIC ACID 8OX - [nb=1] --> .....OLAN-2-YL]-7H-PURIN-8-ONE SHX - [nb=1] --> .....4-YL]-D-PHENYLALANINAMIDE DAH - [nb=1] --> .....,4-DIHYDROXYPHENYLALANINE 0LA - [nb=1] --> .....BAZOL-2-YL)PROPANOIC ACID BME - [nb=1] --> BETA-MERCAPTOETHANOL ZDR - [nb=1] --> .....2-METHYLHEPTANEDIOIC ACID L37 - [nb=1] --> .....L]-CARBONYL-GLUTAMIC ACID 0V3 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE N3A - [nb=1] --> .....PANOYL}AMINO)BENZOIC ACID NTC - [nb=1] --> .....NITROMETHYL SUCCINIC ACID IPM - [nb=1] --> 3-ISOPROPYLMALIC ACID 0O1 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE AQP - [nb=1] --> .....ENOSINE-5'-TETRAPHOSPHATE AYC - [nb=1] --> ALAREMYCIN 2 AFQ - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE 2VE - [nb=1] --> .....RBAZOLE-2-CARBOXYLIC ACID 10D - [nb=1] --> .....L TRIHYDROGEN DIPHOSPHATE 0OX - [nb=1] --> .....)PYRIMIDINE-5-CARBOXAMIDE OC9 - [nb=1] --> OCTAN-1-OL 8OP - [nb=1] --> .....THYL DIHYDROGEN PHOSPHATE LZR - [nb=1] --> .....THOXYQUINAZOLIN-4(3H)-ONE H1L - [nb=1] --> .....XY}PHENOXY)PROPANOIC ACID PVP - [nb=1] --> .....YL]PIPERAZIN-1-YL}ETHANOL 0OV - [nb=1] --> .....DIN-8(5H)-YL]ACETONITRILE S60 - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE RBF - [nb=1] --> RIBOFLAVIN KMB - [nb=1] --> .....ETHYL-3H-QUINAZOLIN-4-ONE AHX - [nb=1] --> .....E-ADENOSINE MONOPHOSPHATE 6X1 - [nb=1] --> .....BAMOYL]AMINO}BENZOIC ACID TTJ - [nb=1] --> .....1,4-dioxane-2-carboxamide V12 - [nb=1] --> .....L)AMINO]-5'-DEOXYCYTIDINE Q03 - [nb=1] --> .....yl)methyl]phosphonic acid 3BG - [nb=1] --> .....L}PIPERAZIN-1-YL)ETHANONE MAU - [nb=1] --> N-METHYL KIRROMYCIN HRD - [nb=1] --> .....ZO[4,5-G]QUINAZOLIN-8-ONE 3BE - [nb=1] --> .....ETHYLIDENE]BENZOHYDRAZIDE PPR - [nb=1] --> PHOSPHONOPYRUVATE AQO - [nb=1] --> .....AMINOQUINAZOLIN-4(3H)-ONE PQ0 - [nb=1] --> .....PYRIMIDINE-5-CARBONITRILE RWX - [nb=1] --> .....HIAZOLE-5-CARBOXYLIC ACID 0R5 - [nb=1] --> .....TRAHYDROGEN TRIPHOSPHATE) BG6 - [nb=1] --> .....TA-D-GLUCOSE-6-PHOSPHATE) 1S9 - [nb=1] --> .....OLIN-7-YL)OXY]ACETIC ACID 8BR - [nb=1] --> .....DENOSINE-5'-MONOPHOSPHATE NHD - [nb=1] --> .....E PURIN-6-OL-DINUCLEOTIDE HM2 - [nb=1] --> .....DIN-2-YLPYRIMIDIN-4-AMINE HM5 - [nb=1] --> .....-YLPYRIDINE-2-CARBOXAMIDE 826 - [nb=1] --> .....XY-2H-PYRIDO[3,4-B]INDOLE P9C - [nb=1] --> .....2,4-DIHYDROXYBENZOIC ACID DXZ - [nb=1] --> .....CARBONYL)-L-GLUTAMIC ACID 3B8 - [nb=1] --> .....-B]PYRIDINE-3-CARBOXAMIDE YZ6 - [nb=1] --> .....IS(OXIDANYL)NON-6-ENAMIDE 0OW - [nb=1] --> .....}PYRIMIDINE-5-CARBOXAMIDE RPD - [nb=1] --> .....HYDANTOCIDIN 5'-PHOSPHATE 03U - [nb=1] --> .....OROBIPHENYL-2-CARBOXYLATE 3BA - [nb=1] --> .....]PYRIMIDINE-6-CARBOXAMIDE 2HO - [nb=1] --> 3,4-DIFLUOROBENZAMIDE FM7 - [nb=1] --> .....NO]PROPYL]PHOSPHONIC ACID U19 - [nb=1] --> .....AZO)-5H-PYRAZOL-3-YLAMINE	Targets for screening
	Sort by entries	[Nb of SA]	[Best Ident]	[Best Score]	Main Code	[Name]	[Number]	[Number]	Distribution of CDocking pKd	[Number]
1	Wbm0438	14	84%	0.696	PF13462		11 - (0)	?	- / - / -	0
2	Wbm0346	25	77%	0.545	PF00164	C1_S1	14 - (0)	0	- / - / 2	0
3	Wbm0653	40	77%	0.587	PF03143	C4_S1	24 - (0)	6	11 / 5 / 2	2
4	Wbm0343	37	77%	0.583	PF03143	C4_S1	26 - (0)	13	13 / 1 / -	4
5	Wbm0756	15	75%	0.463	PF01592	C4_S1	5 - (0)	2	- / - / 1	0
6	Wbm0150	39	74%	0.652	PF09336	C1_S1	25 - (0)	5	- / 17 / 5	3
7	Wbm0292	19	71%	0.611	PF00692	C6_S1	33 - (28)	1	- / - / 1	0
8	Wbm0449	20	71%	0.639	PF14805	C1_S1	29 - (21)	7	- / 3 / 4	3
9	Wbm0468	0	70%	0.409	PF00225		0 - (0)	?	- / - / -	0
10	Wbm0689	20	70%	0.471	PF02874		0 - (0)	?	- / - / -	0
11	Wbm0519	21	70%	0.601	PF00549	C4_S1	21 - (13)	2	- / 9 / -	1
12	Wbm0060	0	69%	0.511	PF00630		0 - (0)	?	- / - / -	0
13	Wbm0553	20	69%	0.530	PF00574	C9_S1	59 - (0)	1	- / - / 1	0
14	Wbm0512	20	69%	0.559	PF02142		0 - (0)	?	- / - / -	0
15	Wbm0244	70	69%	0.642	PF00056	C4_S1	111 - (83)	19	47 / 12 / 6	6
16	Wbm0785	13	68%	0.502	PF00226	C2_S1	4 - (0)	2	- / - / 4	0
17	Wbm0723	21	67%	0.643	PF10431	C5_S1	9 - (0)	2	- / 4 / 1	1
18	Wbm0504	22	67%	0.558	PF00206	C3_S1	16 - (10)	7	- / - / 7	2
19	Wbm0112	91	66%	0.519	PF00557	C1_S1	85 - (1)	20	- / 9 / 64	37
20	Wbm0427	34	66%	0.502	PF00154	C2_S1	31 - (0)	11	- / 15 / 9	5
21	Wbm0205	20	66%	0.539	PF00750		27 - (7)	?	- / - / -	0
22	Wbm0011	10	66%	0.219	PF07690		10 - (0)	?	- / - / -	0
23	Wbm0546	11	66%	0.580	PF02230		21 - (1)	1	- / - / -	0
24	Wbm0520	23	65%	0.588	PF00549	C3_S1	10 - (10)	2	- / 2 / 1	2
25	Wbm0470	78	65%	0.531	PF00106	C1_S1	151 - (84)	20	29 / 40 / 10	8
26	Wbm0495	85	65%	0.597	PF00012	C3_S1	105 - (0)	20	14 / 48 / 12	9
27	Wbm0764	53	65%	0.586	PF01751	C2_S1	62 - (0)	20	6 / 20 / 12	15
28	Wbm0318	22	65%	0.544	PF01193		4 - (0)	2	- / - / -	0
29	Wbm0600	20	65%	0.518	PF13085		104 - (0)	?	- / - / -	0
30	Wbm0350	20	64%	0.537	PF00118		0 - (0)	?	- / - / -	0
31	Wbm0621	8	64%	0.375	PF00361		1 - (0)	?	- / - / -	0
32	Wbm0592	8	64%	0.345	PF01126		0 - (0)	?	- / - / -	0
33	Wbm0154	17	63%	0.609	PF00012	C2_S1	41 - (0)	3	- / 3 / -	2
34	Wbm0552	20	63%	0.569	PF10431		10 - (0)	?	- / - / -	0
35	Wbm0562	17	63%	0.483	PF00589		7 - (0)	?	- / - / -	0
36	Wbm0393	35	63%	0.517	PF04545	C7_S1	30 - (0)	2	18 / - / -	0
37	Wbm0717	73	63%	0.441	PF00334	C8_S1	65 - (57)	20	- / 22 / 38	14
38	Wbm0588	21	63%	0.448	PF01039	C5_S1	5 - (0)	3	- / - / 3	0
39	Wbm0471	8	62%	0.338	PF00037		114 - (0)	?	- / - / -	0
40	Wbm0676	20	62%	0.762	PF00462	C2_S1	20 - (0)	2	- / - / 9	0
41	Wbm0119	58	61%	0.496	PF03952	C1_S1	42 - (33)	9	- / 3 / 30	6
42	Wbm0502	12	61%	0.584	PF01281		1 - (0)	?	- / - / -	0
43	Wbm0028	25	61%	0.556	PF00266	C3_S1	44 - (29)	3	- / - / 14	2
44	Wbm0722	20	61%	0.583	PF00227		22 - (0)	1	- / - / -	0
45	Wbm0583	30	61%	0.582	PF00719	C9_S1	10 - (8)	6	- / - / 8	3
46	Wbm0005	56	61%	0.562	PF00464	C1_S1	104 - (53)	16	- / 2 / 50	4
47	Wbm0657	18	60%	0.570	PF00453		6 - (0)	?	- / - / -	0
48	Wbm0448	35	60%	?	PF02910	C2_S1	50 - (45)	5	28 / - / 2	3
49	Wbm0366	0	60%	0.262	PF01220		1 - (0)	?	- / - / -	0
50	Wbm0314	19	60%	0.585	PF02874		0 - (0)	?	- / - / -	0

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