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]
350bsu0270021 100% 0.798 PF01674 C1_S119 - (6)7 - / - / 9 2
351bsu0209027 100% 0.517 PF00905 C3_S162 - (0)7 - / - / 7 3
352bsu0749030 34% 0.418 PF00005 C1_S119 - (0)7 - / 1 / 10 4
353bsu3712021 79% 0.598 PF01116 C1_S118 - (11)7 - / - / 14 4
354bsu2906021 41% 0.706 PF01121 C3_S124 - (16)7 2 / 6 / 1 3
355bsu3424017 43% 0.473 PF00132 C4_S134 - (27)7 1 / 1 / 8 3
356bsu0433025 46% 0.490 PF00550 C1_S124 - (12)7 - / 7 / 3 3
357bsu1766040 100% 0.502 PF00692 C7_S1135 - (89)7 - / - / 24 3
358bsu1232021 43% 0.547 PF02615 C8_S127 - (17)7 - / 4 / 7 2
359bsu3283029 49% 0.495 PF00108 C8_S116 - (6)7 - / 3 / 2 1
360bsu2421029 47% 0.595 PF00724 C1_S1123 - (61)7 - / - / 10 2
361bsu2773019 59% 0.578 PF05496 C2_S119 - (0)7 - / 10 / 5 3
362bsu2378031 36% 0.555 PF00106 C1_S1113 - (74)7 3 / 2 / 10 2
363bsu0706012 100% 0.680 PF01839 C7_S116 - (0)7 - / - / 6 1
364bsu1643021 55% 0.538 PF07194 C1_S117 - (0)7 - / - / 16 4
365bsu4000026 36% 0.600 PF00106 C2_S199 - (71)7 4 / - / 8 3
366bsu0249030 77% 0.636 PF13378 C1_S115 - (6)7 - / - / 9 2
367bsu3140028 48% 0.665 PF00155 C1_S141 - (29)7 - / 1 / 18 3
368bsu0879016 69% 0.480 PF01964 C3_S112 - (0)7 - / 5 / 5 2
369bsu3773047 43% 0.501 PF00106 C1_S1118 - (92)7 7 / 23 / 1 3
370bsu2245031 44% 0.558 PF12627 C4_S122 - (15)7 - / - / 16 3
371bsu3623019 46% 0.569 PF03721 C1_S123 - (13)7 1 / 4 / 2 3
372bsu2811029 35% 0.332 PF00005 C2_S116 - (0)7 - / 9 / 3 3
373bsu3381020 100% 0.491 PF04069 C2_S127 - (0)7 - / - / 6 3
374bsu3412020 80% 0.602 PF07745 C6_S135 - (1)7 - / 1 / 12 3
375bsu1316016 97% 0.619 PF02566 C2_S113 - (0)7 - / - / 1 0
376bsu2261020 42% 0.509 PF01795 C3_S147 - (37)7 3 / 7 / 3 3
377bsu3294030 32% 0.546 PF00005 C1_S122 - (0)7 - / 1 / 9 3
378bsu1714027 34% 0.464 PF02801 C3_S153 - (1)7 - / - / 7 0
379bsu0382025 35% 0.540 PF00005 C1_S119 - (0)7 - / 7 / 8 5
380bsu2385020 45% 0.554 PF00479 C1_S115 - (13)7 1 / 1 / 7 3
381bsu2357032 73% 0.563 PF00206 C3_S116 - (10)7 - / - / 10 3
382bsu2237030 46% 0.629 PF00155 C1_S139 - (30)7 - / 1 / 22 3
383bsu3948036 54% 0.638 PF08402 C1_S120 - (0)7 - / 15 / 1 4
384bsu3354023 56% 0.578 PF02525 C1_S1168 - (89)7 - / 10 / 2 2
385bsu3760023 49% 0.487 PF07647 C3_S114 - (0)7 - / 1 / 4 3
386bsu0945022 65% 0.559 PF00106 C1_S1104 - (67)7 4 / - / 2 1
387bsu0574030 41% 0.494 PF00245 C6_S115 - (4)7 - / - / 2 1
388bsu0315025 46% 0.506 PF01202 C3_S148 - (41)7 - / 1 / 6 3
389bsu0094020 47% 0.508 PF01406 C3_S130 - (3)7 - / - / 7 2
390bsu3717037 57% 0.452 PF02771 C1_S135 - (35)7 7 / 11 / 5 3
391bsu1488071 43% 0.531 PF00067 C5_S1120 - (0)7 59 / - / 4 1
392bsu2993020 100% 0.545 PF02922 C1_S117 - (0)6 - / - / 6 3
393bsu0735023 48% 0.553 PF00171 C3_S127 - (0)6 1 / - / 3 3
394bsu1917020 57% 0.547 PF02016 C5_S129 - (0)6 - / - / 6 2
395bsu0305051 100% 0.625 PF00056 C5_S161 - (53)6 14 / 16 / 2 2
396bsu0607019 28% 0.412 PF00145 C3_S172 - (24)6 - / - / 6 0
397bsu0705013 100% 0.675 PF08441 C6_S117 - (0)6 - / 1 / 4 2
398bsu2161077 55% 0.556 PF00565 C9_S177 - (0)6 - / 66 / 5 1
399bsu3583020 52% 0.395 PF00083 C1_S124 - (0)6 - / - / 9 5
400bsu0419022 61% 0.553 PF00106 C1_S199 - (59)6 4 / - / 3 1

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