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]
250bsu3502031 100% 0.656 PF01182 C4_S121 - (16)13 - / - / 18 7
251bsu0046031 37% 0.507 PF00288 C1_S166 - (46)17 - / 6 / 13 6
252bsu3316031 40% 0.486 PF00005 C2_S118 - (0)7 - / 1 / 9 3
253bsu2378031 36% 0.555 PF00106 C1_S1113 - (74)7 3 / 2 / 10 2
254bsu2967031 81% 0.550 PF00579 C4_S132 - (20)8 - / 10 / 8 0
255bsu1385031 41% 0.509 PF00403 C1_S114 - (0)10 - / 7 / 2 3
256bsu2245031 44% 0.558 PF12627 C4_S122 - (15)7 - / - / 16 3
257bsu1237031 34% 0.507 PF00356 C2_S140 - (0)2 - / 3 / 20 0
258bsu3109031 100% 0.548 PF02254 C3_S150 - (0)3 - / 11 / 2 3
259bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
260bsu0248031 95% 0.580 PF00150 C1_S154 - (39)20 - / 3 / 14 7
261bsu0464031 56% 0.594 PF01168 C1_S141 - (27)8 - / 4 / 18 3
262bsu0093030 50% 0.650 PF12464 C2_S1130 - (86)6 - / - / 16 1
263bsu1598030 56% 0.600 PF02978 C8_S125 - (0)8 - / 3 / 5 3
264bsu3866030 35% 0.477 PF00005 C1_S132 - (0)10 - / 11 / 5 5
265bsu0574030 41% 0.494 PF00245 C6_S115 - (4)7 - / - / 2 1
266bsu0011030 100% 0.703 PF01680 C6_S119 - (7)6 - / - / 2 1
267bsu0788030 100% 0.684 PF01451 C6_S129 - (2)9 - / - / 14 4
268bsu3294030 32% 0.546 PF00005 C1_S122 - (0)7 - / 1 / 9 3
269bsu2237030 46% 0.629 PF00155 C1_S139 - (30)7 - / 1 / 22 3
270bsu0615030 43% 0.576 PF00107 C1_S152 - (30)9 1 / 2 / 6 1
271bsu0749030 34% 0.418 PF00005 C1_S119 - (0)7 - / 1 / 10 4
272bsu0249030 77% 0.636 PF13378 C1_S115 - (6)7 - / - / 9 2
273bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
274bsu3872030 100% 0.655 PF03853 C2_S159 - (49)20 1 / 7 / 23 9
275bsu3692030 55% 0.527 PF02502 C9_S150 - (37)15 - / - / 9 3
276bsu3964030 42% 0.499 PF00005 C1_S123 - (22)8 - / 8 / 5 4
277bsu3592030 42% 0.578 PF00294 C1_S169 - (56)8 - / 1 / 28 3
278bsu1304030 56% 0.582 PF00175 C1_S173 - (29)10 16 / 3 / 4 2
279bsu3038030 39% 0.488 PF00005 C1_S116 - (0)8 - / 7 / 3 3
280bsu2210030 40% 0.680 PF01081 C2_S126 - (24)5 - / - / 11 2
281bsu1764030 44% 0.574 PF01168 C2_S141 - (29)9 - / 4 / 18 3
282bsu0941030 39% 0.539 PF00245 C5_S116 - (4)8 - / - / 2 1
283bsu0178030 71% 0.566 PF01380 C2_S118 - (15)10 - / - / 11 5
284bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
285bsu1565030 37% 0.440 PF08282 C1_S129 - (23)9 - / 4 / 6 3
286bsu1451030 63% 0.642 PF02254 C2_S147 - (0)2 - / 13 / - 3
287bsu0953030 98% 0.601 PF00248 C5_S143 - (28)7 3 / 1 / 6 2
288bsu3593029 100% 0.571 PF05025 C3_S128 - (0)6 - / - / 12 1
289bsu3897029 43% 0.636 PF00106 C1_S186 - (60)6 - / - / 9 4
290bsu2386029 83% 0.558 PF03446 C2_S127 - (14)10 - / 3 / 9 4
291bsu1830029 43% 0.536 PF00550 C1_S143 - (24)7 - / 13 / 1 5
292bsu2811029 35% 0.332 PF00005 C2_S116 - (0)7 - / 9 / 3 3
293bsu2278029 67% 0.606 PF01227 C13_S122 - (0)8 - / - / 22 3
294bsu2241029 63% 0.677 PF02261 C3_S148 - (8)2 - / 2 / 6 2
295bsu1822029 63% 0.454 PF00378 C2_S128 - (8)6 - / - / 3 1
296bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
297bsu1974029 39% 0.538 PF00202 C1_S159 - (40)5 - / - / 8 1
298bsu0010029 38% 0.566 PF00768 C4_S152 - (0)8 - / - / 3 1
299bsu2289029 62% 0.687 PF02224 C2_S133 - (27)13 1 / 10 / 9 6
300bsu1415029 38% 0.550 PF00258 C1_S188 - (2)3 12 / 4 / 1 2

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