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]
500bsu1606016 48% 0.511 PF01351 C4_S123 - (0)4 - / 2 / 3 1
501bsu1671026 64% 0.562 PF16187 C2_S126 - (0)? - / 2 / 2 0
502bsu2207012 100% 0.606 PF00156 C1_S124 - (10)3 - / 2 / 2 2
503bsu3723022 51% 0.414 PF00005 C2_S15 - (0)2 - / 2 / 2 1
504bsu2750015 69% 0.525 PF02540 C1_S116 - (10)2 - / 2 / 2 1
505bsu3631019 100% 0.470 PF00436 C2_S123 - (0)2 - / 2 / 1 0
506bsu2856020 32% 0.528 PF13193 C3_S132 - (11)3 - / 2 / 1 2
507bsu1354020 43% 0.720 PF01035 C2_S121 - (0)1 - / 2 / 1 0
508bsu1222020 37% 0.601 PF00201 C2_S137 - (0)2 - / 2 / 1 1
509bsu3573019 29% 0.471 PF00534 C1_S113 - (0)3 - / 2 / 1 2
510bsu2417022 49% 0.512 PF00108 C5_S111 - (3)6 - / 2 / 1 1
511bsu3117018 35% 0.525 PF01408 C1_S142 - (13)2 - / 2 / 1 1
512bsu1718012 99% 0.431 PF00550 C1_S16 - (0)3 - / 2 / 1 2
513bsu3187517 50% 0.526 PF01580 C2_S17 - (0)2 - / 2 / 1 2
514bsu0356020 29% 0.573 PF00155 C2_S135 - (20)5 - / 2 / - 2
515bsu351909 34% 0.468 PF01326 C2_S12 - (0)2 - / 2 / - 1
516bsu1743018 56% 0.549 PF01926 C4_S16 - (0)2 - / 2 / - 1
517bsu1093019 44% 0.497 PF01507 C3_S18 - (7)2 - / 2 / - 1
518bsu2544014 98% 0.616 PF04452 C3_S14 - (0)1 - / 2 / - 0
519bsu1477010 32% 0.509 PF03144 C3_S16 - (0)2 - / 2 / - 2
520bsu1832020 47% 0.460 PF00550 C2_S114 - (0)1 - / 2 / - 1
521bsu2754015 36% 0.531 PF00899 C1_S13 - (0)1 - / 2 / - 1
522bsu0363020 60% 0.589 PF02441 C2_S117 - (14)1 - / 2 / - 1
523bsu347606 62% 0.657 PF01933 C3_S117 - (0)1 - / 2 / - 1
524bsu2272016 31% 0.524 PF03705 C4_S14 - (4)2 - / 2 / - 0
525bsu0256019 31% 0.550 PF00512 C1_S116 - (12)2 - / 2 / - 1
526bsu3087020 34% 0.509 PF01370 C1_S148 - (39)3 - / 2 / - 1
527bsu0282019 100% 0.557 PF07719 C2_S119 - (0)? - / 2 / - 0
528bsu1543020 62% 0.448 PF01588 C1_S125 - (10)1 - / 2 / - 1
529bsu1657020 60% 0.579 PF00587 C2_S118 - (10)? - / 2 / - 0
530bsu0844016 59% 0.565 PF01497 C2_S131 - (0)1 - / 2 / - 1
531bsu4023012 100% 0.743 PF02590 C2_S19 - (5)? - / 2 / - 0
532bsu0348021 50% 0.456 PF00550 C2_S114 - (0)1 - / 2 / - 1
533bsu3690065 80% 0.849 PF00464 C1_S1101 - (50)16 - / 1 / 60 4
534bsu0341066 42% 0.503 PF00232 C3_S174 - (58)20 - / 1 / 40 22
535bsu2428054 48% 0.542 PF00348 C1_S179 - (68)20 - / 1 / 39 7
536bsu0007048 100% 0.542 PF00521 C8_S193 - (0)7 - / 1 / 35 0
537bsu2681048 36% 0.578 PF01177 C5_S153 - (37)8 - / 1 / 33 3
538bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
539bsu3592030 42% 0.578 PF00294 C1_S169 - (56)8 - / 1 / 28 3
540bsu2813038 51% 0.641 PF00490 C8_S139 - (22)18 - / 1 / 27 2
541bsu1146045 39% 0.558 PF00005 C1_S146 - (0)10 - / 1 / 26 6
542bsu3390049 100% 0.592 PF03952 C1_S130 - (26)10 - / 1 / 24 7
543bsu2237030 46% 0.629 PF00155 C1_S139 - (30)7 - / 1 / 22 3
544bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
545bsu0373045 37% 0.532 PF00005 C1_S131 - (0)10 - / 1 / 20 5
546bsu3140028 48% 0.665 PF00155 C1_S141 - (29)7 - / 1 / 18 3
547bsu0883039 40% 0.668 PF08402 C1_S125 - (0)12 - / 1 / 17 5
548bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
549bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
550bsu2402018 100% 0.619 PF13411 C2_S127 - (0)2 - / 1 / 13 0

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