Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000001741 (2017 - Acinetobacter Baumannii - ACIBS: Acinetobacter baumannii (strain SDF) [509170])

Download : Data.csv | 3D Common Core | 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]
300B0VLK623 64% 0.54 PF02844 C1_S135 - (25)6 - / 2 / 11 4
301B0VPJ623 45% 0.51 PF08402 C3_S115 - (0)6 - / 8 / 1 2
302B0VVA322 34% 0.64 PF00202 C2_S158 - (36)6 - / 1 / 4 0
303B0VPF628 63% 0.54 PF00749 C2_S119 - (16)6 - / 4 / 7 1
304B0VPZ020 55% 0.52 PF03352 C3_S128 - (0)6 - / - / 5 1
305B0VKV320 48% 0.41 PF00293 C2_S165 - (29)6 - / 1 / 1 1
306B0VU9519 45% 0.47 PF01479 C4_S115 - (0)6 2 / - / 4 0
307B0VUF813 33% 0.42 PF02230 C3_S116 - (1)6 - / - / 6 1
308B0VMS026 56% 0.57 PF00483 C1_S153 - (39)6 - / 13 / 1 3
309B0VTG322 72% 0.50 PF03144 C1_S152 - (0)6 - / 9 / 5 2
310B0VNC825 45% 0.50 PF01243 C1_S142 - (12)6 - / - / 11 1
311B0VR8120 49% 0.59 PF00155 C1_S134 - (27)6 - / - / 6 2
312B0VQP423 50% 0.43 PF01926 C2_S169 - (0)6 5 / 10 / 4 2
313B0VTM930 65% 0.64 PF03740 C6_S127 - (26)6 - / - / 12 3
314B0VM2712 46% 0.49 PF05175 C2_S132 - (22)6 - / 2 / 3 0
315B0VNG620 34% 0.59 PF00378 C2_S122 - (8)6 - / - / 3 0
316B0VMM416 34% 0.47 PF01048 C2_S163 - (0)6 - / - / 4 0
317B0VL8917 67% 0.47 PF01396 C1_S110 - (0)6 2 / - / 4 2
318B0VMJ120 41% 0.40 PF00425 C1_S116 - (0)6 - / - / 5 0
319B0VLG622 88% 0.45 PF10431 C2_S120 - (0)6 1 / 12 / - 3
320B0VRA420 51% 0.47 PF02441 C4_S116 - (9)6 4 / - / 5 3
321B0VUI526 80% 0.52 PF02771 C2_S150 - (40)6 1 / 6 / - 4
322B0VU2920 99% 0.57 PF01588 C1_S125 - (8)6 - / - / 5 2
323B0VQ3445 99% 0.61 PF01202 C3_S159 - (56)6 18 / 8 / 12 2
324B0VPW520 68% 0.47 PF00903 C2_S112 - (0)6 - / 1 / 5 0
325B0VQD120 29% 0.48 PF00149 C1_S127 - (9)6 - / 1 / 4 0
326B0VQK826 50% 0.54 PF02254 C3_S146 - (0)6 - / 5 / 8 3
327B0VU9120 36% 0.57 PF02581 C3_S154 - (42)6 - / - / 7 1
328B0VKL620 37% ? PF00512 C3_S133 - (31)6 1 / 3 / 2 0
329B0VSI820 35% 0.59 PF00465 C5_S137 - (32)6 1 / 2 / - 0
330B0VP1921 44% 0.45 PF00576 C3_S117 - (0)6 - / - / 7 1
331B0VRM819 48% 0.34 PF08282 C1_S112 - (8)6 - / 2 / 3 0
332B0VPY722 55% 0.52 PF14815 C4_S157 - (0)6 3 / - / 2 0
333B0VV2213 61% 0.64 PF00815 C4_S115 - (9)6 - / 2 / 4 2
334B0VQH528 52% 0.51 PF00108 C6_S114 - (4)6 - / 4 / - 1
335B0VUR518 57% 0.62 PF01227 C11_S124 - (0)6 - / 2 / 15 2
336B0VRZ323 38% 0.45 PF00175 C2_S177 - (65)6 - / 4 / 7 0
337B0VS7120 54% 0.58 PF01406 C2_S130 - (15)6 - / 1 / 4 2
338B0VLI621 71% 0.62 PF00578 C1_S117 - (0)6 - / - / 2 0
339B0VLP827 48% 0.69 PF12804 C2_S193 - (77)6 - / - / 8 1
340B0VSK544 52% 0.54 PF02910 C1_S151 - (45)6 29 / 1 / 2 1
341B0VV7026 65% 0.55 PF00437 C4_S117 - (16)6 - / 3 / 7 4
342B0VPR517 48% 0.52 PF00293 C2_S144 - (14)6 - / - / 3 0
343B0VUY420 37% 0.51 PF02567 C2_S118 - (1)6 - / - / 5 1
344B0VS0623 43% 0.53 PF00291 C2_S138 - (37)6 - / 1 / 10 0
345B0VKK912 34% 0.40 PF00106 C1_S177 - (60)6 2 / 2 / - 0
346B0VQD822 43% 0.56 PF01244 C2_S113 - (0)5 - / - / 4 1
347B0VQA218 62% 0.56 PF02091 C1_S118 - (13)5 - / 1 / 3 1
348B0VPN118 36% 0.47 PF05175 C1_S124 - (0)5 - / - / 3 0
349B0VQU620 49% 0.55 PF02771 C2_S142 - (37)5 3 / 3 / - 1
350B0VR8720 65% 0.58 PF00155 C1_S133 - (28)5 - / 1 / 3 1

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