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]
400bsu1138120 99% 0.526 PF00496 C2_S143 - (0)? 2 / - / - 0
401bsu0331017 38% 0.466 PF01568 43 - (0)? - / - / - 0
402bsu3117018 35% 0.525 PF01408 C1_S142 - (13)2 - / 2 / 1 1
403bsu0013032 59% 0.413 PF00587 C3_S142 - (36)10 - / 16 / 9 6
404bsu1236014 27% 0.282 PF07690 42 - (0)? - / - / - 0
405bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
406bsu2407017 55% 0.536 PF00871 C1_S142 - (34)1 - / - / 2 1
407bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
408bsu0537020 32% 0.597 PF00155 C1_S142 - (23)5 - / 1 / 8 3
409bsu0114014 34% 0.496 PF00561 42 - (22)? - / - / - 0
410bsu2918021 72% 0.587 PF02887 42 - (0)1 - / - / - 0
411bsu3804025 33% 0.494 PF00251 C2_S142 - (19)8 - / - / 7 3
412bsu3255046 52% 0.530 PF08402 C1_S142 - (0)12 - / 18 / 7 5
413bsu2520044 75% 0.697 PF04545 C1_S142 - (0)1 17 / - / 4 0
414bsu2859019 37% 0.513 PF14716 C1_S142 - (0)3 - / 1 / 1 2
415bsu2965019 38% 0.340 PF00072 C1_S142 - (0)1 - / - / 2 1
416bsu0082035 79% 0.534 PF01336 C5_S142 - (28)14 - / 11 / 6 6
417bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
418bsu0090037 38% 0.512 PF01128 C1_S142 - (32)9 - / 19 / 5 3
419bsu3061053 39% 0.566 PF08402 C1_S142 - (0)10 - / 6 / 27 5
420bsu1673012 100% 0.594 PF02826 41 - (35)1 - / - / - 0
421bsu251908 39% 0.526 PF00034 41 - (0)? - / - / - 0
422bsu1764030 44% 0.574 PF01168 C2_S141 - (29)9 - / 4 / 18 3
423bsu3140028 48% 0.665 PF00155 C1_S141 - (29)7 - / 1 / 18 3
424bsu1161022 59% 0.539 PF01513 C2_S141 - (32)20 - / 8 / 15 13
425bsu0803017 31% 0.542 PF01207 C3_S141 - (28)2 - / 1 / 1 1
426bsu3950019 37% 0.546 PF00497 41 - (0)? - / - / - 0
427bsu003109 37% 0.586 PF12170 41 - (0)? - / - / - 0
428bsu0019027 53% 0.561 PF12170 C1_S141 - (0)2 - / - / 7 0
429bsu2643022 50% 0.530 PF00486 C2_S141 - (0)4 - / - / 3 2
430bsu3854022 35% 0.477 PF00106 C1_S141 - (28)5 1 / 2 / - 2
431bsu1010017 96% 0.641 PF03992 C2_S141 - (0)2 8 / 1 / - 1
432bsu3097017 40% 0.509 PF00483 C1_S141 - (32)1 - / - / 1 0
433bsu3820021 47% 0.606 PF00288 C2_S141 - (30)5 - / - / 8 3
434bsu0661025 80% 0.456 PF13361 C3_S141 - (0)2 4 / 4 / 8 1
435bsu320207 30% 0.443 PF00174 41 - (11)? - / - / - 0
436bsu0464031 56% 0.594 PF01168 C1_S141 - (27)8 - / 4 / 18 3
437bsu349606 58% 0.447 PF00132 41 - (25)? - / - / - 0
438bsu045503 42% 0.651 PF00085 41 - (0)0 - / - / - 0
439bsu0831028 47% 0.595 PF08402 C1_S140 - (0)5 - / 9 / 2 2
440bsu0338019 97% 0.617 PF00497 40 - (0)? - / - / - 0
441bsu3493020 58% 0.597 PF03129 C3_S140 - (5)5 - / - / 2 2
442bsu3092019 100% 0.590 PF01636 C1_S140 - (0)1 - / - / 2 1
443bsu0893022 70% 0.643 PF00588 C3_S140 - (0)5 - / 10 / 3 0
444bsu2703032 44% 0.519 PF00251 C3_S140 - (0)8 - / 2 / 9 2
445bsu0984014 23% 0.491 PF04055 40 - (9)? - / - / - 0
446bsu1157010 41% 0.574 PF01464 C4_S140 - (0)1 - / - / 2 1
447bsu2868020 31% 0.465 PF01565 40 - (30)? - / - / - 0
448bsu0567013 41% 0.525 PF01047 40 - (0)1 - / - / - 0
449bsu0018021 61% 0.619 PF00383 C5_S140 - (8)4 2 / 3 / 2 0
450bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7

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