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]
100bsu2267066 43% 0.504 PF00591 C7_S191 - (1)20 - / 22 / 33 8
101bsu0809038 40% 0.542 PF02852 C2_S191 - (71)5 26 / - / 1 1
102bsu0077072 67% 0.658 PF00809 C3_S189 - (33)20 - / - / 61 26
103bsu253100 44% 0.520 PF01219 89 - (0)? - / - / - 0
104bsu2025018 45% 0.429 PF00145 C2_S189 - (28)5 1 / - / 8 0
105bsu1415029 38% 0.550 PF00258 C1_S188 - (2)3 12 / 4 / 1 2
106bsu1156020 100% 0.640 PF01152 C5_S188 - (0)3 5 / - / 1 0
107bsu4011022 65% 0.601 PF00232 C2_S188 - (72)11 - / 4 / 7 5
108bsu1734072 100% 0.514 PF01423 C5_S187 - (0)15 - / - / 48 4
109bsu3897029 43% 0.636 PF00106 C1_S186 - (60)6 - / - / 9 4
110bsu1143020 35% 0.488 PF00496 85 - (0)? - / - / - 0
111bsu3099020 32% 0.435 PF09515 C6_S185 - (0)1 - / - / 1 0
112bsu4034056 78% 0.554 PF00202 C1_S184 - (55)12 - / 8 / 30 4
113bsu1296019 34% 0.458 PF00496 84 - (0)1 - / - / - 0
114bsu2264085 61% 0.590 PF00291 C3_S184 - (75)19 7 / 13 / 44 10
115bsu1677052 61% 0.622 PF00701 C4_S184 - (75)9 - / - / 15 3
116bsu0073076 84% 0.600 PF00291 C2_S183 - (53)20 - / 8 / 60 9
117bsu3527015 51% 0.585 PF13442 C1_S183 - (0)2 - / 1 / - 1
118bsu1091051 54% 0.633 PF14306 C2_S183 - (76)13 2 / 36 / 5 8
119bsu0081020 37% 0.619 PF01207 C1_S182 - (44)2 5 / 3 / - 1
120bsu2349075 57% 0.580 PF01048 C3_S182 - (43)20 - / 7 / 53 20
121bsu2831022 47% 0.594 PF02776 C5_S182 - (38)15 12 / 4 / 10 4
122bsu1003032 100% 0.468 PF01230 C3_S182 - (0)9 - / 4 / 7 3
123bsu2726069 53% 0.627 PF00291 C2_S181 - (52)16 - / 4 / 50 6
124bsu0769052 52% 0.628 PF00557 C2_S181 - (0)20 - / - / 32 11
125bsu0330022 33% 0.571 PF07992 C3_S181 - (55)4 - / - / 3 0
126bsu0107043 95% 0.418 PF04560 C7_S181 - (0)2 - / - / 25 0
127bsu0138079 51% 0.605 PF00557 C2_S180 - (0)20 - / - / 52 32
128bsu4101013 58% 0.452 PF01266 C6_S180 - (69)2 2 / - / - 1
129bsu3784066 54% 0.528 PF00483 C1_S180 - (72)20 - / 15 / 39 8
130bsu1121040 44% 0.561 PF00696 C1_S179 - (66)13 - / 5 / 17 4
131bsu1902022 51% 0.548 PF01593 C4_S179 - (78)3 3 / 3 / - 1
132bsu2428054 48% 0.542 PF00348 C1_S179 - (68)20 - / 1 / 39 7
133bsu0332020 32% 0.510 PF07992 C2_S178 - (47)2 - / - / 2 0
134bsu2564050 100% 0.636 PF01467 C1_S178 - (45)18 10 / 10 / 13 7
135bsu0566018 72% 0.603 PF00881 78 - (49)2 - / - / - 0
136bsu3783025 51% 0.488 PF16363 C1_S178 - (69)4 21 / 3 / - 2
137bsu3122012 33% 0.538 PF00106 78 - (57)? - / - / - 0
138bsu1818043 50% 0.478 PF00483 C1_S178 - (70)15 - / 14 / 22 5
139bsu3506020 99% 0.541 PF00067 C2_S178 - (0)4 6 / - / - 1
140bsu2273081 72% 0.639 PF00334 C7_S177 - (76)20 - / 45 / 31 12
141bsu1700020 35% 0.430 PF04055 C2_S177 - (24)3 - / 4 / 3 1
142bsu2161077 55% 0.556 PF00565 C9_S177 - (0)6 - / 66 / 5 1
143bsu3034059 100% 0.669 PF13426 C2_S177 - (0)3 20 / 18 / 7 2
144bsu0821052 54% 0.468 PF00005 C1_S177 - (0)8 - / 19 / 21 5
145bsu1760075 76% 0.568 PF01261 C3_S176 - (67)20 - / - / 40 15
146bsu3984022 41% 0.585 PF00106 C2_S176 - (50)3 4 / - / 1 1
147bsu4025025 67% 0.618 PF00107 C1_S176 - (48)4 6 / 1 / 4 1
148bsu2182058 98% 0.702 PF00303 C8_S175 - (41)18 - / 9 / 32 7
149bsu1762074 56% 0.550 PF00565 C6_S175 - (0)6 - / 64 / 6 1
150bsu2975056 76% 0.544 PF00793 C2_S174 - (74)8 - / - / 38 4

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