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]
250bsu3109031 100% 0.548 PF02254 C3_S150 - (0)3 - / 11 / 2 3
251bsu0248031 95% 0.580 PF00150 C1_S154 - (39)20 - / 3 / 14 7
252bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
253bsu3316031 40% 0.486 PF00005 C2_S118 - (0)7 - / 1 / 9 3
254bsu0464031 56% 0.594 PF01168 C1_S141 - (27)8 - / 4 / 18 3
255bsu0046031 37% 0.507 PF00288 C1_S166 - (46)17 - / 6 / 13 6
256bsu2245031 44% 0.558 PF12627 C4_S122 - (15)7 - / - / 16 3
257bsu2378031 36% 0.555 PF00106 C1_S1113 - (74)7 3 / 2 / 10 2
258bsu1385031 41% 0.509 PF00403 C1_S114 - (0)10 - / 7 / 2 3
259bsu3502031 100% 0.656 PF01182 C4_S121 - (16)13 - / - / 18 7
260bsu1237031 34% 0.507 PF00356 C2_S140 - (0)2 - / 3 / 20 0
261bsu2967031 81% 0.550 PF00579 C4_S132 - (20)8 - / 10 / 8 0
262bsu0093030 50% 0.650 PF12464 C2_S1130 - (86)6 - / - / 16 1
263bsu0749030 34% 0.418 PF00005 C1_S119 - (0)7 - / 1 / 10 4
264bsu0953030 98% 0.601 PF00248 C5_S143 - (28)7 3 / 1 / 6 2
265bsu3964030 42% 0.499 PF00005 C1_S123 - (22)8 - / 8 / 5 4
266bsu1451030 63% 0.642 PF02254 C2_S147 - (0)2 - / 13 / - 3
267bsu0615030 43% 0.576 PF00107 C1_S152 - (30)9 1 / 2 / 6 1
268bsu0941030 39% 0.539 PF00245 C5_S116 - (4)8 - / - / 2 1
269bsu1304030 56% 0.582 PF00175 C1_S173 - (29)10 16 / 3 / 4 2
270bsu3866030 35% 0.477 PF00005 C1_S132 - (0)10 - / 11 / 5 5
271bsu3592030 42% 0.578 PF00294 C1_S169 - (56)8 - / 1 / 28 3
272bsu3038030 39% 0.488 PF00005 C1_S116 - (0)8 - / 7 / 3 3
273bsu1598030 56% 0.600 PF02978 C8_S125 - (0)8 - / 3 / 5 3
274bsu2237030 46% 0.629 PF00155 C1_S139 - (30)7 - / 1 / 22 3
275bsu0574030 41% 0.494 PF00245 C6_S115 - (4)7 - / - / 2 1
276bsu3294030 32% 0.546 PF00005 C1_S122 - (0)7 - / 1 / 9 3
277bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
278bsu1565030 37% 0.440 PF08282 C1_S129 - (23)9 - / 4 / 6 3
279bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
280bsu3872030 100% 0.655 PF03853 C2_S159 - (49)20 1 / 7 / 23 9
281bsu1764030 44% 0.574 PF01168 C2_S141 - (29)9 - / 4 / 18 3
282bsu0788030 100% 0.684 PF01451 C6_S129 - (2)9 - / - / 14 4
283bsu0178030 71% 0.566 PF01380 C2_S118 - (15)10 - / - / 11 5
284bsu3692030 55% 0.527 PF02502 C9_S150 - (37)15 - / - / 9 3
285bsu0011030 100% 0.703 PF01680 C6_S119 - (7)6 - / - / 2 1
286bsu2210030 40% 0.680 PF01081 C2_S126 - (24)5 - / - / 11 2
287bsu0249030 77% 0.636 PF13378 C1_S115 - (6)7 - / - / 9 2
288bsu2386029 83% 0.558 PF03446 C2_S127 - (14)10 - / 3 / 9 4
289bsu1974029 39% 0.538 PF00202 C1_S159 - (40)5 - / - / 8 1
290bsu3897029 43% 0.636 PF00106 C1_S186 - (60)6 - / - / 9 4
291bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
292bsu2241029 63% 0.677 PF02261 C3_S148 - (8)2 - / 2 / 6 2
293bsu3439029 97% 0.845 PF00135 C1_S1100 - (24)15 - / - / 11 0
294bsu2278029 67% 0.606 PF01227 C13_S122 - (0)8 - / - / 22 3
295bsu0010029 38% 0.566 PF00768 C4_S152 - (0)8 - / - / 3 1
296bsu1822029 63% 0.454 PF00378 C2_S128 - (8)6 - / - / 3 1
297bsu2289029 62% 0.687 PF02224 C2_S133 - (27)13 1 / 10 / 9 6
298bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
299bsu2421029 47% 0.595 PF00724 C1_S1123 - (61)7 - / - / 10 2
300bsu3283029 49% 0.495 PF00108 C8_S116 - (6)7 - / 3 / 2 1

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