Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
NR_HUMAN_I90_2021M5 (2021 - Homo sapiens - Human family of nuclear receptors)

Download : Data.csv | 3D Common Core | 3D Models | DB.fasta


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]
1H_NR0B1_DAX11 68% 0.21 PF00105 C1_S15 - (0)? - / - / - 0
2H_NR0B2_SHP15 81% 0.43 PF00105 C1_S14 - (0)? - / - / - 0
3H_NR1A1_THRa20 100% 0.22 PF00105 C1_S120 - (0)11 - / 19 / 1 8
4H_NR1A2_THRb27 100% 0.29 PF00105 C1_S127 - (0)14 8 / 19 / - 10
5H_NR1B1_RARa21 100% 0.33 PF00105 C1_S122 - (0)18 14 / 5 / 2 14
6H_NR1B2_RARb26 100% 0.32 PF00105 C1_S126 - (0)20 18 / 7 / 1 14
7H_NR1B3_RARg19 100% 0.49 PF00105 C1_S119 - (0)17 14 / 5 / - 14
8H_NR1C1_PPARa73 100% 0.48 PF00105 C1_S1103 - (0)20 23 / 29 / 18 32
9H_NR1C2_PPARb65 100% 0.49 PF00105 C1_S1136 - (0)12 - / - / 37 4
10H_NR1C3_PPARg299 100% 0.44 PF00105 C1_S1352 - (0)20 98 / 102 / 94 171
11H_NR1D1_REVa14 100% 0.18 PF00105 C2_S112 - (0)2 2 / - / - 2
12H_NR1D2_REVb18 99% 0.25 PF00105 C2_S116 - (0)3 6 / - / - 2
13H_NR1F1_RORa21 100% 0.36 PF00105 C1_S122 - (0)19 4 / 13 / 2 15
14H_NR1F2_RORb20 98% 0.44 PF00105 C1_S119 - (0)18 2 / 16 / - 16
15H_NR1F3_RORg217 100% 0.29 PF00105 C1_S1277 - (0)20 133 / 68 / 16 99
16H_NR1H2_LXRb56 100% 0.57 PF00105 C1_S160 - (0)20 29 / 17 / 5 22
17H_NR1H3_LXRa26 100% 0.46 PF00105 C1_S126 - (0)20 17 / 7 / - 15
18H_NR1H4_FXR130 100% 0.33 PF00105 C1_S1133 - (0)20 104 / 17 / 9 54
19H_NR1I1_VDR20 83% 0.50 PF00105 C1_S120 - (0)20 20 / - / - 18
20H_NR1I2_PXR50 100% 0.43 PF00105 C1_S162 - (0)20 5 / 31 / 13 30
21H_NR1I3_CAR20 98% 0.39 PF00105 C1_S114 - (0)2 1 / 1 / - 2
22H_NR2A1_HNF4a20 100% 0.37 PF00105 C1_S17 - (0)5 - / 2 / 5 3
23H_NR2A2_HNF4g20 100% 0.30 PF00105 C1_S115 - (0)4 - / 2 / 2 3
24H_NR2B1_RXRa110 100% 0.46 PF00105 C1_S1114 - (0)20 28 / 58 / 16 51
25H_NR2B2_RXRb21 100% 0.27 PF00105 C1_S119 - (0)12 5 / 9 / 3 9
26H_NR2B3_RXRg21 100% 0.32 PF00105 C1_S118 - (0)17 4 / 12 / 2 12
27H_NR2C1_TR220 72% 0.15 PF00105 C1_S12 - (0)? - / - / - 0
28H_NR2C2_TR420 99% 0.15 PF00105 C1_S12 - (0)? - / - / - 0
29H_NR2E1_TLX18 98% 0.39 PF00105 C1_S111 - (0)? - / - / - 0
30H_NR2E3_PNR20 99% 0.26 PF00105 C1_S113 - (0)? - / - / - 0
31H_NR2F1_COT120 96% 0.28 PF00105 C1_S111 - (0)1 - / - / 1 1
32H_NR2F2_COT220 99% 0.44 PF00105 C1_S112 - (0)1 - / 1 / - 0
33H_NR2F6_EAR220 71% 0.38 PF00105 C1_S115 - (0)? - / - / - 0
34H_NR3A1_ERa485 100% 0.34 PF00105 C1_S1492 - (0)20 154 / 299 / 29 221
35H_NR3A2_ERb68 100% 0.28 PF00105 C1_S177 - (0)20 3 / 53 / 12 29
36H_NR3B1_ERRa21 100% 0.28 PF00105 C1_S122 - (0)17 2 / 11 / 3 14
37H_NR3B2_ERRb20 98% 0.27 PF00105 C1_S116 - (0)12 - / 6 / 4 8
38H_NR3B3_ERRg37 100% 0.31 PF00105 C1_S141 - (0)20 6 / 21 / 6 17
39H_NR3C1_GCR50 99% 0.20 PF00105 C1_S177 - (0)20 22 / 15 / 8 17
40H_NR3C2_MCR41 99% 0.16 PF00105 C1_S145 - (0)20 9 / 30 / 1 20
41H_NR3C3_PRGR35 100% 0.23 PF00105 C1_S137 - (0)20 8 / 27 / - 17
42H_NR3C4_ANDR97 100% 0.21 -C1_S1110 - (0)20 6 / 77 / 14 30
43H_NR4A1_NGFIB28 100% 0.27 PF00105 C1_S129 - (0)3 - / - / 3 1
44H_NR4A2_NURR124 100% 0.28 PF00105 C1_S115 - (0)3 - / - / 1 0
45H_NR4A3_NOR120 65% 0.24 PF00105 C1_S115 - (0)2 - / - / - 0
46H_NR5A1_STF120 99% 0.32 PF00105 C1_S120 - (0)17 14 / 5 / - 13
47H_NR5A2_LRH125 100% 0.29 PF00105 C1_S129 - (0)17 13 / 10 / - 13
48H_NR6A1_GCN119 98% 0.10 PF00105 C1_S11 - (0)? - / - / - 0

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