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]
150bsu3042053 44% 0.655 PF00005 C1_S139 - (0)12 - / 9 / 27 5
151bsu0883039 40% 0.668 PF08402 C1_S125 - (0)12 - / 1 / 17 5
152bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
153bsu0967022 44% 0.560 PF01063 C8_S151 - (39)12 - / 8 / 14 5
154bsu4034056 78% 0.554 PF00202 C1_S184 - (55)12 - / 8 / 30 4
155bsu3926027 60% 0.545 PF00232 C1_S191 - (74)12 - / - / 10 6
156bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7
157bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
158bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
159bsu2566057 45% 0.553 PF08501 C6_S168 - (63)12 5 / 15 / 26 4
160bsu1577029 50% 0.489 PF00069 C1_S156 - (15)12 1 / 4 / 10 8
161bsu2725034 60% 0.581 PF01053 C1_S123 - (17)12 - / 2 / 14 5
162bsu0283036 55% 0.557 PF00106 C1_S1110 - (73)12 19 / 11 / 3 4
163bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
164bsu1312020 49% 0.518 PF14850 C1_S134 - (26)12 6 / - / 8 5
165bsu0588020 77% 0.551 PF02156 C1_S146 - (22)12 - / - / 5 2
166bsu3423030 47% 0.571 PF01041 C1_S145 - (0)12 1 / 2 / 13 6
167bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
168bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
169bsu0078040 63% 0.593 PF02152 C5_S137 - (25)12 - / - / 22 8
170bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
171bsu3470043 43% 0.532 PF00005 C1_S127 - (0)11 - / 5 / 17 6
172bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
173bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
174bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
175bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
176bsu2759037 55% 0.552 PF02580 C10_S123 - (0)11 - / 3 / 9 1
177bsu2864032 79% 0.477 PF01409 C1_S126 - (13)11 - / 8 / 6 8
178bsu1377034 57% 0.624 PF00106 C1_S1102 - (56)11 2 / 4 / 6 3
179bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
180bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
181bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
182bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
183bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
184bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
185bsu2909071 69% 0.537 PF00476 C4_S1184 - (118)11 37 / 18 / 8 0
186bsu2956017 37% 0.541 PF13193 C4_S170 - (15)11 - / 2 / 5 3
187bsu3526041 40% 0.554 PF08402 C1_S123 - (0)10 - / 14 / 7 5
188bsu3390049 100% 0.592 PF03952 C1_S130 - (26)10 - / 1 / 24 7
189bsu2386029 83% 0.558 PF03446 C2_S127 - (14)10 - / 3 / 9 4
190bsu2829025 69% 0.479 PF07991 C4_S137 - (0)10 5 / 3 / 9 0
191bsu0359038 59% 0.553 PF08402 C1_S131 - (0)10 - / 16 / 14 5
192bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
193bsu2266023 48% 0.470 PF00218 C1_S113 - (5)10 - / 5 / 4 5
194bsu1146045 39% 0.558 PF00005 C1_S146 - (0)10 - / 1 / 26 6
195bsu3021018 39% 0.486 PF00155 C1_S120 - (16)10 - / - / 11 5
196bsu2786045 45% 0.548 PF02749 C7_S133 - (22)10 - / - / 17 3
197bsu0457019 39% 0.540 PF08245 C1_S146 - (22)10 1 / 6 / - 4
198bsu3866030 35% 0.477 PF00005 C1_S132 - (0)10 - / 11 / 5 5
199bsu2319026 100% 0.540 PF00768 C5_S135 - (0)10 - / - / 9 2
200bsu3886049 65% 0.611 PF16363 C1_S1139 - (120)10 43 / 10 / - 4

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