Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
UP000000534 (WOLTR: Wolbachia sp. subsp. Brugia malayi - Nov 2015)

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]
1Wbm074151 45% 0.488 PF02511 C12_S1323 - (285)13 - / 16 / 34 6
2Wbm072588 46% 0.502 PF09281 C4_S1307 - (199)20 46 / 28 / 11 13
3Wbm009853 44% 0.515 PF01180 C3_S1184 - (114)15 49 / 10 / 7 3
4Wbm058945 39% 0.525 PF06827 C12_S1168 - (0)5 3 / 15 / 17 0
5Wbm071949 35% 0.583 PF00762 C7_S1151 - (0)10 18 / 3 / 23 4
6Wbm047078 65% 0.531 PF00106 C1_S1151 - (84)20 29 / 40 / 10 8
7Wbm04590 37% 0.079 PF00137 141 - (0)? - / - / - 0
8Wbm012349 44% 0.606 PF00034 C4_S1141 - (54)9 28 / 6 / 7 3
9Wbm032142 47% 0.647 PF05191 C2_S1131 - (121)8 1 / 28 / 1 2
10Wbm042039 59% 0.577 PF00551 C4_S1125 - (15)14 1 / 17 / 9 6
11Wbm017975 43% 0.575 PF13288 C4_S1120 - (57)20 27 / 18 / 34 20
12Wbm070842 45% 0.614 PF00271 C3_S1117 - (0)9 - / 7 / 14 5
13Wbm004660 48% 0.610 PF02401 C10_S1117 - (0)20 - / 2 / 78 15
14Wbm077521 56% 0.414 PF13631 115 - (0)1 - / - / - 0
15Wbm04718 62% 0.338 PF00037 114 - (0)? - / - / - 0
16Wbm056920 51% 0.578 PF00037 114 - (0)? - / - / - 0
17Wbm056640 54% 0.628 PF07992 C2_S1113 - (99)11 17 / 9 / 6 3
18Wbm024470 69% 0.642 PF00056 C4_S1111 - (83)19 47 / 12 / 6 6
19Wbm011476 49% 0.507 PF01327 C7_S1111 - (30)20 - / 9 / 52 9
20Wbm014820 56% 0.606 PF01712 C3_S1110 - (59)4 - / 2 / 2 1
21Wbm02250 36% -0.027 PF00155 110 - (89)? - / - / - 0
22Wbm075989 42% 0.589 PF00012 C2_S1106 - (0)20 4 / 54 / 17 9
23Wbm049585 65% 0.597 PF00012 C3_S1105 - (0)20 14 / 48 / 12 9
24Wbm000556 61% 0.562 PF00464 C1_S1104 - (53)16 - / 2 / 50 4
25Wbm060020 65% 0.518 PF13085 104 - (0)? - / - / - 0
26Wbm080447 42% 0.524 PF01255 C10_S1102 - (28)20 1 / 18 / 24 14
27Wbm080155 50% 0.507 PF01467 C3_S1101 - (83)14 2 / 15 / 32 8
28Wbm035562 58% 0.456 PF00692 C3_S197 - (76)13 - / - / 43 3
29Wbm040986 50% 0.405 PF02542 C8_S194 - (75)20 - / - / 67 4
30Wbm004946 50% 0.553 PF02978 C8_S187 - (60)13 3 / 13 / 12 4
31Wbm011291 66% 0.519 PF00557 C1_S185 - (1)20 - / 9 / 64 37
32Wbm068452 43% 0.600 PF00162 C10_S185 - (75)19 - / 20 / 26 9
33Wbm050736 54% 0.619 PF00111 C6_S184 - (84)2 - / - / 32 1
34Wbm040541 51% 0.539 PF00521 C2_S182 - (0)8 - / 2 / 30 1
35Wbm042962 39% 0.556 PF02768 C6_S181 - (0)20 - / 22 / 35 2
36Wbm024035 47% 0.632 PF01230 C6_S177 - (0)11 - / 3 / 13 5
37Wbm051716 33% 0.350 PF00881 75 - (49)? - / - / - 0
38Wbm027344 48% 0.562 PF00709 C3_S173 - (54)18 - / 32 / 10 7
39Wbm012928 42% 0.514 PF00202 C1_S172 - (42)6 - / 1 / 9 4
40Wbm029618 56% 0.464 PF07647 72 - (0)? - / - / - 0
41Wbm073726 38% 0.571 PF00348 C1_S171 - (57)10 - / 2 / 11 3
42Wbm068517 41% 0.568 PF07992 C1_S170 - (59)2 7 / - / - 1
43Wbm075319 46% 0.569 PF01070 C2_S169 - (58)4 2 / 4 / - 2
44Wbm025721 39% 0.428 PF00488 C6_S167 - (0)2 - / 12 / 8 0
45Wbm02870 42% 0.474 PF07647 67 - (0)? - / - / - 0
46Wbm071773 63% 0.441 PF00334 C8_S165 - (57)20 - / 22 / 38 14
47Wbm003217 54% 0.488 PF01926 C1_S164 - (0)3 - / 5 / - 2
48Wbm022732 59% 0.437 PF01259 C2_S164 - (47)8 - / 24 / 7 5
49Wbm018930 39% 0.486 PF00885 C5_S164 - (41)2 - / 1 / 15 4
50Wbm04860 34% 0.325 PF01127 C9_S164 - (0)1 - / 1 / - 0

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