Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001570 (Bacillus subtilis - May 2016)

Download : Data.csv | 3D Models


Tab legend :
    Full name of ligand selected in the comparative docking column:

    General color information : Quality: [ Good | Correct | Uncertain ]
QueryStructural Alignment (SA)3D Modeling AnnotationLigands from PDB templatesPredicted Complexes - pKd:[ ‹nMol | ‹μMol | ‹mMol ]




 Query Sequence
Filter: 		Significants
SA found		 Seq Ident. 3D Core
(QMean Score)		 Classification code

 Binding Site Ligands Found
(Procognate)		 Profile Complexes by comparative docking
(ligands from PDB templates)

 Targets
for screening


Sort by entries

 [Nb of SA]
 [Best Ident]
 [Best Score]
 Main Code
 [Name]
 [Number]
 [Number]
 Distribution of CDocking pKd
 [Number]
400bsu016504 45% 0.548 PF00118 6 - (1)? - / - / - 0
401bsu0603020 64% ? PF00118 0 - (0)? - / - / - 0
402bsu368705 34% 0.326 PF00119 2 - (0)? - / - / - 0
403bsu101601 47% 0.319 PF00121 0 - (0)? - / - / - 0
404bsu3392056 69% 0.555 PF00121 C7_S153 - (30)20 - / - / 32 0
405bsu163500 42% 0.319 PF00122 3 - (0)? - / - / - 0
406bsu121400 36% 0.272 PF00122 7 - (0)? - / - / - 0
407bsu250300 35% 0.128 PF00124 104 - (0)? - / - / - 0
408bsu384600 23% 0.799 PF00125 2 - (0)? - / - / - 0
409bsu286600 50% 0.525 PF00128 7 - (0)? - / - / - 0
410bsu100900 37% 0.284 PF00129 0 - (0)? - / - / - 0
411bsu049104 25% 0.334 PF00129 4 - (0)? - / - / - 0
412bsu367800 32% 0.388 PF00132 2 - (0)? - / - / - 0
413bsu3424017 43% 0.473 PF00132 C4_S134 - (27)7 1 / 1 / 8 3
414bsu3052024 77% 0.575 PF00132 65 - (34)3 - / - / - 0
415bsu349606 58% 0.447 PF00132 41 - (25)? - / - / - 0
416bsu4085027 70% 0.635 PF00132 C1_S169 - (35)4 - / - / 12 1
417bsu027209 37% 0.230 PF00134 2 - (0)? - / - / - 0
418bsu304300 30% 0.213 PF00135 16 - (4)? - / - / - 0
419bsu3439029 97% 0.845 PF00135 C1_S1100 - (24)15 - / - / 11 0
420bsu368607 59% 0.308 PF00137 102 - (0)? - / - / - 0
421bsu110700 36% 0.283 PF00141 1 - (0)? - / - / - 0
422bsu097600 34% 0.589 PF00144 0 - (0)? - / - / - 0
423bsu1695020 34% 0.506 PF00144 20 - (0)? - / - / - 0
424bsu3444020 32% 0.397 PF00144 C2_S127 - (0)3 - / - / 2 0
425bsu0167020 28% 0.430 PF00144 C2_S138 - (0)3 - / - / 2 0
426bsu0606018 38% 0.354 PF00145 C1_S168 - (25)2 - / 1 / 1 1
427bsu0607019 28% 0.412 PF00145 C3_S172 - (24)6 - / - / 6 0
428bsu2025018 45% 0.429 PF00145 C2_S189 - (28)5 1 / - / 8 0
429bsu3660032 40% 0.542 PF00145 C4_S1108 - (35)7 1 / 30 / 4 1
430bsu031000 27% 0.341 PF00148 2 - (0)? - / - / - 0
431bsu369103 49% 0.544 PF00148 2 - (0)? - / - / - 0
432bsu2298016 22% 0.472 PF00149 2 - (0)? - / - / - 0
433bsu4022019 22% 0.367 PF00149 2 - (0)? - / - / - 0
434bsu1337012 28% 0.486 PF00149 10 - (0)? - / - / - 0
435bsu1994017 21% 0.295 PF00149 C3_S15 - (0)1 - / - / 1 0
436bsu1405017 37% 0.413 PF00149 6 - (0)1 - / - / - 0
437bsu1064013 30% 0.496 PF00149 C1_S114 - (0)3 - / - / 3 0
438bsu0991014 31% 0.409 PF00149 C1_S16 - (0)1 - / - / 1 0
439bsu323707 27% 0.497 PF00149 13 - (7)? - / - / - 0
440bsu0919020 29% 0.457 PF00149 C1_S120 - (8)4 - / 1 / 3 2
441bsu0784023 99% 0.592 PF00149 C1_S118 - (0)5 - / - / 3 1
442bsu3588015 26% 0.417 PF00149 7 - (0)? - / - / - 0
443bsu0262019 100% 0.479 PF00149 10 - (0)1 - / - / - 0
444bsu3504016 19% 0.345 PF00149 4 - (0)? - / - / - 0
445bsu1697020 100% 0.701 PF00149 7 - (0)? - / - / - 0
446bsu0248031 95% 0.580 PF00150 C1_S154 - (39)20 - / 3 / 14 7
447bsu1813032 99% 0.539 PF00150 C1_S159 - (42)20 - / 3 / 14 7
448bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
449bsu1744013 76% 0.543 PF00155 6 - (4)1 - / - / - 0
450bsu3144019 43% 0.644 PF00155 C1_S132 - (24)4 - / - / 9 1

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