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]
300bsu4092021 60% 0.502 PF07670 C1_S152 - (0)6 - / 2 / 4 3
301bsu0400049 52% 0.528 PF00180 C6_S152 - (42)13 - / 4 / 26 3
302bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
303bsu1495010 45% 0.532 PF00571 52 - (0)? - / - / - 0
304bsu1017040 45% 0.509 PF08541 C2_S152 - (31)18 - / 3 / 15 4
305bsu0010029 38% 0.566 PF00768 C4_S152 - (0)8 - / - / 3 1
306bsu2234015 78% 0.585 PF14815 C1_S151 - (0)2 - / 1 / 3 0
307bsu2406045 44% 0.565 PF02852 C3_S151 - (47)4 31 / - / 1 2
308bsu1133037 58% 0.542 PF08541 C2_S151 - (31)17 - / 6 / 13 3
309bsu1418013 80% 0.674 PF12804 51 - (35)? - / - / - 0
310bsu0192014 30% 0.468 PF04055 51 - (8)? - / - / - 0
311bsu2274038 41% 0.619 PF00348 C1_S151 - (32)17 - / - / 23 6
312bsu125106 36% 0.534 PF00717 51 - (0)? - / - / - 0
313bsu126800 29% 0.488 PF11798 51 - (48)? - / - / - 0
314bsu0687020 100% 0.582 PF12680 51 - (6)2 - / - / - 0
315bsu4032074 71% 0.595 PF00491 C7_S151 - (22)20 - / - / 32 12
316bsu1784039 66% 0.636 PF00903 C1_S151 - (0)14 - / - / 27 4
317bsu0967022 44% 0.560 PF01063 C8_S151 - (39)12 - / 8 / 14 5
318bsu1198022 34% 0.573 PF00106 C1_S151 - (30)2 - / - / 2 0
319bsu3100014 41% 0.584 PF00583 C1_S151 - (16)4 2 / - / 2 2
320bsu2787015 38% 0.454 PF02910 C1_S150 - (45)5 4 / - / 1 2
321bsu2211019 48% 0.470 PF00294 C1_S150 - (36)2 - / - / 3 0
322bsu3692030 55% 0.527 PF02502 C9_S150 - (37)15 - / - / 9 3
323bsu3109031 100% 0.548 PF02254 C3_S150 - (0)3 - / 11 / 2 3
324bsu1856024 35% 0.572 PF02826 C3_S150 - (39)6 - / 1 / 3 1
325bsu3233015 50% 0.560 PF04055 C4_S149 - (13)5 - / 1 / 4 1
326bsu2761028 55% 0.584 PF00156 C3_S149 - (38)8 - / 6 / 13 3
327bsu0643031 61% 0.595 PF02222 C2_S149 - (36)9 - / 12 / 10 5
328bsu2328022 100% 0.587 PF00383 C3_S149 - (0)3 2 / - / 1 1
329bsu3768019 100% 0.604 PF00106 C2_S149 - (25)2 1 / - / - 1
330bsu255007 25% 0.521 PF04055 C2_S149 - (11)1 - / - / 1 0
331bsu006603 34% 0.353 PF00069 49 - (13)? - / - / - 0
332bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
333bsu3248017 41% 0.470 PF01791 49 - (17)2 - / - / - 0
334bsu3596022 59% 0.613 PF13407 C1_S149 - (0)4 - / 2 / 13 2
335bsu3907027 99% 0.547 PF00722 C2_S148 - (20)8 - / 4 / 3 1
336bsu1640023 100% 0.691 PF00448 C9_S148 - (0)7 - / 3 / 7 3
337bsu0315025 46% 0.506 PF01202 C3_S148 - (41)7 - / 1 / 6 3
338bsu1229020 42% 0.591 PF07992 48 - (0)? - / - / - 0
339bsu3087020 34% 0.509 PF01370 C1_S148 - (39)3 - / 2 / - 1
340bsu2241029 63% 0.677 PF02261 C3_S148 - (8)2 - / 2 / 6 2
341bsu2733025 54% 0.532 PF00485 C1_S148 - (35)14 4 / 9 / 8 7
342bsu329007 38% 0.382 PF00106 C5_S148 - (35)1 - / - / 2 0
343bsu1857018 25% 0.455 PF01568 48 - (0)? - / - / - 0
344bsu3452020 32% 0.603 PF01565 48 - (31)? - / - / - 0
345bsu1088020 33% 0.542 PF00155 C2_S147 - (25)8 1 / 4 / 7 4
346bsu2968022 35% 0.542 PF13193 C3_S147 - (9)8 - / 2 / 3 4
347bsu1014020 100% 0.604 PF01593 C1_S147 - (27)2 5 / - / - 1
348bsu0571020 99% 0.578 PF00704 47 - (0)1 - / - / - 0
349bsu201600 45% 0.467 PF01546 47 - (0)? - / - / - 0
350bsu0593013 31% 0.501 PF00583 C1_S147 - (26)2 - / 1 / 2 0

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