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]
150bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
151bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
152bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
153bsu4034056 78% 0.554 PF00202 C1_S184 - (55)12 - / 8 / 30 4
154bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
155bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
156bsu3042053 44% 0.655 PF00005 C1_S139 - (0)12 - / 9 / 27 5
157bsu0967022 44% 0.560 PF01063 C8_S151 - (39)12 - / 8 / 14 5
158bsu3926027 60% 0.545 PF00232 C1_S191 - (74)12 - / - / 10 6
159bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
160bsu1311037 58% 0.546 PF02844 C7_S159 - (7)12 - / 23 / - 8
161bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
162bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7
163bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
164bsu0078040 63% 0.593 PF02152 C5_S137 - (25)12 - / - / 22 8
165bsu2725034 60% 0.581 PF01053 C1_S123 - (17)12 - / 2 / 14 5
166bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
167bsu0588020 77% 0.551 PF02156 C1_S146 - (22)12 - / - / 5 2
168bsu0283036 55% 0.557 PF00106 C1_S1110 - (73)12 19 / 11 / 3 4
169bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
170bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
171bsu2909071 69% 0.537 PF00476 C4_S1184 - (118)11 37 / 18 / 8 0
172bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
173bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
174bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
175bsu3470043 43% 0.532 PF00005 C1_S127 - (0)11 - / 5 / 17 6
176bsu2864032 79% 0.477 PF01409 C1_S126 - (13)11 - / 8 / 6 8
177bsu2759037 55% 0.552 PF02580 C10_S123 - (0)11 - / 3 / 9 1
178bsu2956017 37% 0.541 PF13193 C4_S170 - (15)11 - / 2 / 5 3
179bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
180bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
181bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
182bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
183bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
184bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
185bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
186bsu1377034 57% 0.624 PF00106 C1_S1102 - (56)11 2 / 4 / 6 3
187bsu1122051 45% 0.565 PF00202 C1_S155 - (34)10 - / 4 / 21 3
188bsu0390053 47% 0.585 PF00202 C1_S161 - (32)10 - / 6 / 20 3
189bsu0652023 44% 0.495 PF02142 C12_S117 - (10)10 2 / 7 / 3 3
190bsu2496034 38% 0.527 PF00005 C1_S121 - (0)10 - / 5 / 13 6
191bsu3061053 39% 0.566 PF08402 C1_S142 - (0)10 - / 6 / 27 5
192bsu2786045 45% 0.548 PF02749 C7_S133 - (22)10 - / - / 17 3
193bsu2386029 83% 0.558 PF03446 C2_S127 - (14)10 - / 3 / 9 4
194bsu2521020 65% 0.591 PF01807 C3_S115 - (0)10 - / 7 / 5 6
195bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
196bsu1385031 41% 0.509 PF00403 C1_S114 - (0)10 - / 7 / 2 3
197bsu3940024 73% 0.545 PF07831 C9_S127 - (3)10 - / - / 12 5
198bsu0594024 45% 0.592 PF00814 C2_S132 - (25)10 - / 14 / 4 5
199bsu3526041 40% 0.554 PF08402 C1_S123 - (0)10 - / 14 / 7 5
200bsu0178030 71% 0.566 PF01380 C2_S118 - (15)10 - / - / 11 5

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