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]
150bsu3479043 71% 0.511 PF07992 C3_S1113 - (96)12 6 / 19 / 7 3
151bsu2566057 45% 0.553 PF08501 C6_S168 - (63)12 5 / 15 / 26 4
152bsu0883039 40% 0.668 PF08402 C1_S125 - (0)12 - / 1 / 17 5
153bsu0313033 100% 0.789 PF02540 C5_S166 - (59)12 - / 14 / 16 5
154bsu0283036 55% 0.557 PF00106 C1_S1110 - (73)12 19 / 11 / 3 4
155bsu4034056 78% 0.554 PF00202 C1_S184 - (55)12 - / 8 / 30 4
156bsu0822058 55% 0.482 PF00005 C2_S199 - (88)12 - / 27 / 12 5
157bsu1311037 58% 0.546 PF02844 C7_S159 - (7)12 - / 23 / - 8
158bsu2396034 64% 0.544 PF08402 C1_S129 - (0)12 - / 16 / 9 5
159bsu2934033 54% 0.650 PF08402 C1_S126 - (0)12 - / 15 / 7 5
160bsu2743039 62% 0.613 PF08402 C1_S142 - (0)12 - / 21 / 7 5
161bsu1147045 37% 0.545 PF08402 C1_S140 - (0)12 - / 7 / 21 7
162bsu3255046 52% 0.530 PF08402 C1_S142 - (0)12 - / 18 / 7 5
163bsu3689046 84% 0.544 PF14681 C6_S149 - (38)12 - / 10 / 21 5
164bsu3926027 60% 0.545 PF00232 C1_S191 - (74)12 - / - / 10 6
165bsu2725034 60% 0.581 PF01053 C1_S123 - (17)12 - / 2 / 14 5
166bsu0006036 73% 0.601 PF01751 C3_S131 - (0)12 2 / 16 / 5 8
167bsu0642036 80% 0.612 PF00731 C7_S133 - (26)12 - / 1 / 16 4
168bsu0588020 77% 0.551 PF02156 C1_S146 - (22)12 - / - / 5 2
169bsu1188034 51% 0.605 PF01053 C1_S122 - (16)12 - / 1 / 16 5
170bsu2956017 37% 0.541 PF13193 C4_S170 - (15)11 - / 2 / 5 3
171bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
172bsu1377034 57% 0.624 PF00106 C1_S1102 - (56)11 2 / 4 / 6 3
173bsu0053032 53% 0.622 PF01195 C6_S115 - (0)11 - / 1 / 6 4
174bsu1694036 69% 0.607 PF00154 C1_S142 - (0)11 - / 17 / 8 5
175bsu1592035 100% 0.792 PF00550 C7_S138 - (0)11 - / - / 8 2
176bsu0668030 64% 0.471 PF01425 C3_S152 - (0)11 - / - / 8 1
177bsu1142032 100% 0.575 PF00579 C4_S135 - (24)11 4 / 3 / 6 3
178bsu3076040 35% 0.578 PF00005 C1_S133 - (0)11 - / 1 / 21 5
179bsu3706044 70% 0.467 PF00265 C10_S142 - (41)11 13 / 16 / 3 5
180bsu0645031 68% 0.470 PF01259 C3_S160 - (45)11 - / 19 / 11 6
181bsu3470043 43% 0.532 PF00005 C1_S127 - (0)11 - / 5 / 17 6
182bsu0223020 56% 0.531 PF02222 C1_S154 - (39)11 - / 7 / 13 5
183bsu2864032 79% 0.477 PF01409 C1_S126 - (13)11 - / 8 / 6 8
184bsu2759037 55% 0.552 PF02580 C10_S123 - (0)11 - / 3 / 9 1
185bsu0146048 54% 0.582 PF00005 C1_S145 - (0)11 - / 1 / 33 5
186bsu2909071 69% 0.537 PF00476 C4_S1184 - (118)11 37 / 18 / 8 0
187bsu3567022 53% 0.488 PF00483 C1_S166 - (52)10 - / 11 / 5 3
188bsu2382032 100% 0.686 PF00724 C2_S1178 - (105)10 2 / 8 / 10 3
189bsu2786045 45% 0.548 PF02749 C7_S133 - (22)10 - / - / 17 3
190bsu1555021 100% 0.871 PF00215 C2_S139 - (26)10 - / 12 / 2 3
191bsu3061053 39% 0.566 PF08402 C1_S142 - (0)10 - / 6 / 27 5
192bsu0652023 44% 0.495 PF02142 C12_S117 - (10)10 2 / 7 / 3 3
193bsu0013032 59% 0.413 PF00587 C3_S142 - (36)10 - / 16 / 9 6
194bsu2829025 69% 0.479 PF07991 C4_S137 - (0)10 5 / 3 / 9 0
195bsu3193025 63% 0.600 PF05222 C3_S167 - (57)10 3 / 6 / 6 3
196bsu0373045 37% 0.532 PF00005 C1_S131 - (0)10 - / 1 / 20 5
197bsu0457019 39% 0.540 PF08245 C1_S146 - (22)10 1 / 6 / - 4
198bsu3390049 100% 0.592 PF03952 C1_S130 - (26)10 - / 1 / 24 7
199bsu0359038 59% 0.553 PF08402 C1_S131 - (0)10 - / 16 / 14 5
200bsu2521020 65% 0.591 PF01807 C3_S115 - (0)10 - / 7 / 5 6

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