Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
SLC (Dec 2015)

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]
1SC6A7_HUMAN20 47% 0.440 PF13520 C6_S168 - (0)15 - / - / 10 2
2SC6A4_HUMAN20 53% 0.483 PF13520 C6_S137 - (0)13 - / 6 / 8 6
3SC6A2_HUMAN20 59% 0.409 PF13520 C5_S151 - (0)9 - / 2 / 3 4
4SC6A3_HUMAN20 55% 0.401 PF13520 C6_S143 - (0)8 - / 1 / 5 3
5S6A14_HUMAN20 44% 0.402 PF13520 C4_S176 - (0)8 - / - / 7 1
6S6A13_HUMAN20 46% 0.427 PF13520 C8_S175 - (0)7 - / - / 1 1
7SC6A8_HUMAN20 45% 0.381 PF13520 C8_S159 - (0)5 - / 1 / 4 0
8EAA5_HUMAN35 37% 0.296 PF00873 C4_S122 - (0)4 - / - / 22 2
9EAA2_HUMAN33 35% 0.353 PF08037 C7_S123 - (0)4 - / - / 22 2
10EAA4_HUMAN28 38% 0.280 PF00873 C3_S122 - (0)4 - / - / 22 2
11EAA3_HUMAN32 35% 0.287 PF00873 C13_S122 - (0)4 - / - / 22 2
12AAAT_HUMAN36 50% 0.318 PF00873 C4_S122 - (0)4 - / - / 21 2
13EAA1_HUMAN34 35% 0.355 PF00873 C6_S122 - (0)4 - / - / 22 2
14SATT_HUMAN36 47% 0.345 PF04608 C8_S122 - (0)4 - / - / 21 2
15SC6A9_HUMAN20 44% 0.440 PF13520 58 - (0)3 - / - / - 0
16ADT1_HUMAN14 96% 0.241 PF00153 C5_S128 - (0)3 - / 3 / 2 1
17ADT3_HUMAN14 90% 0.217 PF00153 C5_S128 - (0)3 - / - / 9 1
18SC6A1_HUMAN20 46% 0.450 PF13520 C4_S155 - (0)3 - / - / 1 0
19ADT4_HUMAN16 73% 0.255 PF00153 C3_S128 - (0)3 - / - / 4 1
20ADT2_HUMAN14 90% 0.197 PF00153 C4_S128 - (0)3 - / 3 / 2 1
21SC6A5_HUMAN20 46% 0.387 PF13520 C6_S143 - (0)3 - / - / 2 0
22UT2_HUMAN9 63% 0.480 PF03253 C2_S115 - (0)2 - / 1 / 2 1
23GTR14_HUMAN19 94% 0.402 PF00083 15 - (0)2 - / - / - 0
24S27A3_HUMAN20 27% 0.405 PF13193 C1_S154 - (23)2 - / 2 / - 2
25S27A1_HUMAN20 38% 0.489 PF13193 C4_S154 - (26)2 - / 2 / - 2
26GTR4_HUMAN18 64% 0.412 PF00083 15 - (0)2 - / - / - 0
27GTR3_HUMAN19 99% 0.444 PF00083 15 - (0)2 - / - / - 0
28GTR1_HUMAN20 99% 0.411 PF00083 C1_S113 - (0)2 - / - / 1 0
29GTR9_HUMAN16 38% 0.398 PF00083 C3_S113 - (0)2 - / - / 1 0
30B3AT_HUMAN18 100% 0.538 PF00955 4 - (0)2 - / - / - 0
31GDC_HUMAN11 30% 0.134 PF00153 C5_S116 - (0)1 - / - / 2 0
32SC6A6_HUMAN20 47% 0.374 PF13520 60 - (0)1 - / - / - 0
33UCP1_HUMAN13 58% 0.018 PF00153 23 - (0)1 - / - / - 0
34SL9A1_HUMAN7 100% 0.287 PF00999 3 - (0)1 - / - / - 0
35B3A3_HUMAN18 89% 0.486 PF00955 5 - (0)1 - / - / - 0
36MPCP_HUMAN6 30% 0.246 PF00153 23 - (0)1 - / - / - 0
37NAC1_HUMAN21 98% 0.616 PF01699 5 - (0)1 - / - / - 0
38NAC2_HUMAN21 68% 0.371 PF01699 4 - (0)1 - / - / - 0
39S27A4_HUMAN20 26% 0.466 PF13193 C4_S162 - (27)1 - / 1 / - 1
40S27A6_HUMAN14 31% 0.393 PF13193 C2_S153 - (23)1 - / - / 1 1
41UT1_HUMAN9 79% 0.499 PF03253 C3_S115 - (0)1 - / - / 2 0
42NHRF2_HUMAN13 100% 0.765 PF00595 47 - (0)1 - / - / - 0
43NAC3_HUMAN20 97% 0.456 PF01699 4 - (0)1 - / - / - 0
44S6A12_HUMAN20 47% 0.427 PF13520 71 - (0)1 - / - / - 0
45GTR2_HUMAN18 52% 0.446 PF00083 C1_S115 - (0)1 - / - / 1 0
46S7A13_HUMAN6 24% 0.255 PF13520 5 - (0)? - / - / - 0
47SL9B1_HUMAN2 30% 0.332 PF00999 2 - (0)? - / - / - 0
48S38A5_HUMAN4 40% 0.302 PF02932 1 - (0)? - / - / - 0
49S36A2_HUMAN4 21% 0.235 PF13520 1 - (0)? - / - / - 0
50NTCP_HUMAN5 40% 0.227 PF06965 11 - (0)? - / - / - 0

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