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]
250bsu3802027 100% 0.547 PF08543 C2_S163 - (48)9 - / 3 / 12 2
251bsu1590027 49% 0.595 PF00698 C1_S119 - (14)9 - / - / 7 0
252bsu2573024 41% 0.464 PF03446 C1_S130 - (16)9 - / - / 13 4
253bsu2412027 74% 0.598 PF02548 C4_S132 - (20)9 - / - / 10 3
254bsu1815022 91% 0.529 PF02055 C2_S135 - (2)9 - / 1 / 3 1
255bsu1300050 36% 0.497 PF00005 C1_S144 - (0)9 - / 5 / 22 5
256bsu3488024 44% 0.693 PF00977 C1_S129 - (0)9 2 / 5 / 4 5
257bsu3409025 34% 0.447 PF00005 C1_S130 - (0)9 - / 3 / 6 4
258bsu0869038 61% 0.408 PF00005 C2_S132 - (0)9 - / 18 / 4 6
259bsu2214025 55% 0.605 PF00106 C1_S1120 - (69)9 3 / 5 / 1 3
260bsu3373035 43% 0.641 PF08402 C2_S135 - (0)9 - / 9 / 5 4
261bsu3468026 48% 0.588 PF02826 C1_S161 - (37)9 6 / 3 / 5 3
262bsu3395018 100% 0.633 PF04198 C3_S136 - (15)8 - / - / 9 5
263bsu1483026 61% 0.588 PF04960 C6_S132 - (15)8 - / - / 12 2
264bsu4040018 100% 0.563 PF00512 C3_S140 - (25)8 3 / 9 / 1 4
265bsu0351024 99% 0.552 PF00550 C1_S154 - (28)8 - / 13 / 2 5
266bsu2262024 52% 0.606 PF00155 C1_S127 - (21)8 - / 1 / 8 3
267bsu2326034 57% 0.649 PF00926 C7_S126 - (0)8 - / - / 21 3
268bsu1554023 68% 0.542 PF01180 C1_S168 - (39)8 - / 3 / 8 3
269bsu1221056 100% 0.569 PF00067 C6_S1117 - (0)8 41 / - / 5 1
270bsu2967031 81% 0.550 PF00579 C4_S132 - (20)8 - / 10 / 8 0
271bsu2278029 67% 0.606 PF01227 C13_S122 - (0)8 - / - / 22 3
272bsu1598030 56% 0.600 PF02978 C8_S125 - (0)8 - / 3 / 5 3
273bsu0821052 54% 0.468 PF00005 C1_S177 - (0)8 - / 19 / 21 5
274bsu1172032 100% 0.614 PF00106 C5_S168 - (36)8 17 / 8 / 1 3
275bsu1088020 33% 0.542 PF00155 C2_S147 - (25)8 1 / 4 / 7 4
276bsu0010029 38% 0.566 PF00768 C4_S152 - (0)8 - / - / 3 1
277bsu0449025 42% 0.416 PF00005 C1_S128 - (0)8 - / 1 / 10 4
278bsu1013020 100% 0.865 PF00762 C2_S124 - (3)8 2 / 2 / 3 4
279bsu1547025 100% 0.609 PF00156 C2_S161 - (23)8 - / 7 / 9 2
280bsu1318023 52% 0.467 PF01717 C4_S113 - (5)8 - / 1 / 5 2
281bsu2788028 34% 0.520 PF00266 C1_S146 - (35)8 - / - / 24 2
282bsu3435017 36% 0.501 PF02719 C1_S157 - (55)8 12 / 2 / 2 4
283bsu3020017 31% 0.570 PF02374 C1_S144 - (39)8 - / 8 / 3 3
284bsu2968022 35% 0.542 PF13193 C3_S147 - (9)8 - / 2 / 3 4
285bsu2681048 36% 0.578 PF01177 C5_S153 - (37)8 - / 1 / 33 3
286bsu3954024 100% 0.483 PF02275 C6_S115 - (10)8 - / - / 4 0
287bsu0177020 79% 0.598 PF00408 C3_S115 - (14)8 - / - / 7 6
288bsu2446033 65% 0.569 PF00557 C1_S120 - (1)8 - / 1 / 7 0
289bsu2826020 37% 0.450 PF00694 C4_S120 - (7)8 - / - / 2 2
290bsu2722020 40% 0.538 PF00698 C1_S115 - (10)8 - / - / 7 0
291bsu3942038 61% 0.640 PF01791 C2_S137 - (9)8 - / - / 14 2
292bsu1863019 100% 0.659 PF03330 C3_S120 - (0)8 - / 2 / 8 4
293bsu3055033 71% 0.513 PF00438 C6_S114 - (9)8 - / - / 8 0
294bsu1826035 50% 0.550 PF02771 C1_S137 - (37)8 4 / 12 / 7 4
295bsu3038030 39% 0.488 PF00005 C1_S116 - (0)8 - / 7 / 3 3
296bsu3344073 46% 0.544 PF00175 C2_S1106 - (90)8 37 / 15 / 1 4
297bsu3964030 42% 0.499 PF00005 C1_S123 - (22)8 - / 8 / 5 4
298bsu3907027 99% 0.547 PF00722 C2_S148 - (20)8 - / 4 / 3 1
299bsu3175020 61% 0.533 PF04095 C6_S128 - (5)8 - / - / 5 3
300bsu0243028 100% 0.611 PF04960 C6_S121 - (15)8 - / - / 8 3

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