Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
NR_HUMAN_I90_2019M8 (2019 - 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_NR3A1_ERa502 100% 0.34 PF00105 78.20 - (0)? 132 / 327 / 43 221
2H_NR1C3_PPARg247 100% 0.44 PF00105 66.70 - (0)? 82 / 84 / 78 150
3H_NR1H4_FXR126 100% 0.33 PF00105 51.90 - (0)? 102 / 15 / 9 75
4H_NR1F3_RORg155 100% 0.29 PF00105 56.40 - (0)? 82 / 59 / 14 74
5H_NR2B1_RXRa89 100% 0.38 PF00105 85.90 - (0)? 23 / 50 / 11 44
6H_NR3C4_ANDR97 100% 0.21 -66.60 - (0)? 6 / 77 / 14 35
7H_NR3A2_ERb68 100% 0.28 PF00105 78.00 - (0)? 3 / 53 / 12 30
8H_NR3C2_MCR35 99% 0.16 PF00105 76.90 - (0)? 9 / 26 / 1 20
9H_NR3C1_GCR44 99% 0.20 PF00105 68.10 - (0)? 22 / 15 / 8 18
10H_NR1C1_PPARa26 100% 0.48 PF00105 74.50 - (0)? 13 / 10 / 3 17
11H_NR3C3_PRGR33 100% 0.23 PF00105 81.40 - (0)? 8 / 25 / - 16
12H_NR1H2_LXRb32 100% 0.45 PF00105 67.70 - (0)? 19 / 8 / 3 14
13H_NR1I2_PXR25 100% 0.42 PF00105 63.20 - (0)? 3 / 18 / 4 13
14H_NR1H3_LXRa15 100% 0.37 PF00105 83.20 - (0)? 11 / 4 / - 9
15H_NR1B3_RARg10 100% 0.45 PF00105 92.20 - (0)? 8 / 2 / - 9
16H_NR1A2_THRb22 100% 0.29 PF00105 82.90 - (0)? 7 / 15 / - 9
17H_NR5A2_LRH118 100% 0.27 PF00105 81.10 - (0)? 13 / 5 / - 8
18H_NR3B3_ERRg21 100% 0.32 PF00105 61.20 - (0)? 3 / 14 / 3 8
19H_NR5A1_STF18 99% 0.32 PF00105 95.20 - (0)? 8 / - / - 6
20H_NR1B1_RARa8 100% 0.30 PF00105 84.90 - (0)? 5 / 1 / 2 6
21H_NR1B2_RARb14 100% 0.32 PF00105 92.30 - (0)? 9 / 5 / - 5
22H_NR1C2_PPARb58 100% 0.49 PF00105 89.80 - (0)? - / - / 37 4
23H_NR1A1_THRa8 100% 0.22 PF00105 84.70 - (0)? - / 8 / - 4
24H_NR1F1_RORa4 100% 0.36 PF00105 88.00 - (0)? 2 / 2 / - 3
25H_NR1F2_RORb3 98% 0.44 PF00105 83.40 - (0)? - / 3 / - 3
26H_NR4A1_NGFIB27 100% 0.27 PF00105 50.00 - (0)? - / - / 3 2
27H_NR1D2_REVb2 99% 0.23 -100.00 - (0)? 2 / - / - 2
28H_NR2B2_RXRb5 100% 0.30 PF00105 93.90 - (0)? 4 / - / 1 2
29H_NR3B1_ERRa3 100% 0.28 PF00105 64.60 - (0)? 2 / 1 / - 2
30H_NR2A1_HNF4a6 100% 0.28 PF00105 98.60 - (0)? - / 2 / 4 2
31H_NR2A2_HNF4g1 100% 0.24 PF00105 87.50 - (0)? - / 1 / - 1
32H_NR1I3_CAR1 98% 0.41 PF00105 100.00 - (0)? 1 / - / - 1

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