Structure of PDB 8vie Chain A Binding Site BS01
Receptor Information
>8vie Chain A (length=367) Species:
9606
(Homo sapiens) [
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IQCSQRMLSFSDALLSIIATVMILPVTHTEISPEQQFDRSVQRLLATRIA
VYLMTFLIVTVAWAAHTRLFQVVGKTDDTLALLNLACMMTITFLPYTFSL
MVTFPDVPLGIFLFCVCVIAIGVVQALIVGYAFHFPHLLSPQIQEPLSKE
RVEAFSDGVYAIVATLLILDICEDNVPDPKDVKERFSGSLVAALSATGPR
FLAYFGSFATVGLLWFAHHSLFLHVRKATRAMGLLNTLSLAFVGGLPLAY
QQTSAFARQPRDELERVRVSCTIIFLASIFQLAMWTTALLHQAETLQPSV
WFGGREHVLMFAKLALYPCASLLAFASTCLLSRFSVGIFHLMQIAVPCAF
LLLRLLVGLALATLRVL
Ligand information
Ligand ID
A1AB0
InChI
InChI=1S/C11H10N2/c12-10-6-7-13-11(8-10)9-4-2-1-3-5-9/h1-8H,(H2,12,13)
InChIKey
CHVKPWIABFICLK-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.385
Nc1ccnc(c1)c2ccccc2
ACDLabs 12.01
Nc1ccnc(c1)c1ccccc1
OpenEye OEToolkits 2.0.7
c1ccc(cc1)c2cc(ccn2)N
Formula
C11 H10 N2
Name
2-phenylpyridin-4-amine
ChEMBL
DrugBank
ZINC
PDB chain
8vie Chain A Residue 601 [
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Receptor-Ligand Complex Structure
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PDB
8vie
Structure of human TMEM175 in an inhibitor-bound state
Resolution
3.52 Å
Binding residue
(original residue number in PDB)
A42 I46 G267
Binding residue
(residue number reindexed from 1)
A13 I17 G158
Annotation score
1
External links
PDB
RCSB:8vie
,
PDBe:8vie
,
PDBj:8vie
PDBsum
8vie
PubMed
UniProt
Q9BSA9
|TM175_HUMAN Endosomal/lysosomal proton channel TMEM175 (Gene Name=TMEM175)
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