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]
150bsu2725034 60% 0.581 PF01053 C1_S123 - (17)12 - / 2 / 14 5
151bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
152bsu1025023 47% 0.584 PF03099 C2_S127 - (17)12 3 / 2 / 13 3
153bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
154bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
155bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
156bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7
157bsu3255046 52% 0.530 PF08402 C1_S142 - (0)12 - / 18 / 7 5
158bsu4034056 78% 0.554 PF00202 C1_S184 - (55)12 - / 8 / 30 4
159bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
160bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
161bsu0967022 44% 0.560 PF01063 C8_S151 - (39)12 - / 8 / 14 5
162bsu3042053 44% 0.655 PF00005 C1_S139 - (0)12 - / 9 / 27 5
163bsu0588020 77% 0.551 PF02156 C1_S146 - (22)12 - / - / 5 2
164bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
165bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
166bsu1311037 58% 0.546 PF02844 C7_S159 - (7)12 - / 23 / - 8
167bsu0078040 63% 0.593 PF02152 C5_S137 - (25)12 - / - / 22 8
168bsu2396034 64% 0.544 PF08402 C1_S129 - (0)12 - / 16 / 9 5
169bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
170bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
171bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
172bsu1377034 57% 0.624 PF00106 C1_S1102 - (56)11 2 / 4 / 6 3
173bsu2956017 37% 0.541 PF13193 C4_S170 - (15)11 - / 2 / 5 3
174bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
175bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
176bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
177bsu2864032 79% 0.477 PF01409 C1_S126 - (13)11 - / 8 / 6 8
178bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
179bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
180bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
181bsu3470043 43% 0.532 PF00005 C1_S127 - (0)11 - / 5 / 17 6
182bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
183bsu2909071 69% 0.537 PF00476 C4_S1184 - (118)11 37 / 18 / 8 0
184bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
185bsu2759037 55% 0.552 PF02580 C10_S123 - (0)11 - / 3 / 9 1
186bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
187bsu3021018 39% 0.486 PF00155 C1_S120 - (16)10 - / - / 11 5
188bsu0457019 39% 0.540 PF08245 C1_S146 - (22)10 1 / 6 / - 4
189bsu0594024 45% 0.592 PF00814 C2_S132 - (25)10 - / 14 / 4 5
190bsu1304030 56% 0.582 PF00175 C1_S173 - (29)10 16 / 3 / 4 2
191bsu1385031 41% 0.509 PF00403 C1_S114 - (0)10 - / 7 / 2 3
192bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
193bsu3390049 100% 0.592 PF03952 C1_S130 - (26)10 - / 1 / 24 7
194bsu3940024 73% 0.545 PF07831 C9_S127 - (3)10 - / - / 12 5
195bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
196bsu0013032 59% 0.413 PF00587 C3_S142 - (36)10 - / 16 / 9 6
197bsu2521020 65% 0.591 PF01807 C3_S115 - (0)10 - / 7 / 5 6
198bsu1529053 100% 0.623 PF00091 C3_S156 - (0)10 1 / 30 / 13 5
199bsu2236023 46% 0.520 PF01336 C7_S122 - (16)10 - / 9 / 1 5
200bsu3061053 39% 0.566 PF08402 C1_S142 - (0)10 - / 6 / 27 5

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