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]
150bsu1311037 58% 0.546 PF02844 C7_S159 - (7)12 - / 23 / - 8
151bsu0283036 55% 0.557 PF00106 C1_S1110 - (73)12 19 / 11 / 3 4
152bsu1312020 49% 0.518 PF14850 C1_S134 - (26)12 6 / - / 8 5
153bsu2396034 64% 0.544 PF08402 C1_S129 - (0)12 - / 16 / 9 5
154bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
155bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
156bsu0967022 44% 0.560 PF01063 C8_S151 - (39)12 - / 8 / 14 5
157bsu0588020 77% 0.551 PF02156 C1_S146 - (22)12 - / - / 5 2
158bsu4034056 78% 0.554 PF00202 C1_S184 - (55)12 - / 8 / 30 4
159bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7
160bsu3926027 60% 0.545 PF00232 C1_S191 - (74)12 - / - / 10 6
161bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
162bsu0078040 63% 0.593 PF02152 C5_S137 - (25)12 - / - / 22 8
163bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
164bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
165bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
166bsu0006036 73% 0.601 PF01751 C3_S131 - (0)12 2 / 16 / 5 8
167bsu2566057 45% 0.553 PF08501 C6_S168 - (63)12 5 / 15 / 26 4
168bsu3255046 52% 0.530 PF08402 C1_S142 - (0)12 - / 18 / 7 5
169bsu3042053 44% 0.655 PF00005 C1_S139 - (0)12 - / 9 / 27 5
170bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
171bsu2956017 37% 0.541 PF13193 C4_S170 - (15)11 - / 2 / 5 3
172bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
173bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
174bsu3470043 43% 0.532 PF00005 C1_S127 - (0)11 - / 5 / 17 6
175bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
176bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
177bsu2909071 69% 0.537 PF00476 C4_S1184 - (118)11 37 / 18 / 8 0
178bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
179bsu1377034 57% 0.624 PF00106 C1_S1102 - (56)11 2 / 4 / 6 3
180bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
181bsu2759037 55% 0.552 PF02580 C10_S123 - (0)11 - / 3 / 9 1
182bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
183bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
184bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
185bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
186bsu2864032 79% 0.477 PF01409 C1_S126 - (13)11 - / 8 / 6 8
187bsu2496034 38% 0.527 PF00005 C1_S121 - (0)10 - / 5 / 13 6
188bsu3021018 39% 0.486 PF00155 C1_S120 - (16)10 - / - / 11 5
189bsu1187038 50% 0.586 PF01053 C1_S121 - (15)10 - / 2 / 15 4
190bsu1529053 100% 0.623 PF00091 C3_S156 - (0)10 1 / 30 / 13 5
191bsu3526041 40% 0.554 PF08402 C1_S123 - (0)10 - / 14 / 7 5
192bsu0373045 37% 0.532 PF00005 C1_S131 - (0)10 - / 1 / 20 5
193bsu2266023 48% 0.470 PF00218 C1_S113 - (5)10 - / 5 / 4 5
194bsu2829025 69% 0.479 PF07991 C4_S137 - (0)10 5 / 3 / 9 0
195bsu0594024 45% 0.592 PF00814 C2_S132 - (25)10 - / 14 / 4 5
196bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
197bsu0013032 59% 0.413 PF00587 C3_S142 - (36)10 - / 16 / 9 6
198bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
199bsu3866030 35% 0.477 PF00005 C1_S132 - (0)10 - / 11 / 5 5
200bsu1122051 45% 0.565 PF00202 C1_S155 - (34)10 - / 4 / 21 3

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