Structure of PDB 8vic Chain A Binding Site BS01

Receptor Information
>8vic Chain A (length=358) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
IQCSQRMLSFSDALLSIIATVMILPVTHTEIDRSVQRLLATRIAVYLMTF
LIVTVAWAAHTRLFQVVGKTDDTLALLNLACMMTITFLPYTFSLMVTFPD
VPLGIFLFCVCVIAIGVVQALIVGYAFHFPHLLSPQIQEPLSKERVEAFS
DGVYAIVATLLILDICEDNVPDPKDVKERFSGSLVAALSATGPRFLAYFG
SFATVGLLWFAHHSLFLHVRKATRAMGLLNTLSLAFVGGLPLAYQQTSAF
ARQPRDELERVRVSCTIIFLASIFQLAMWTTALLHQAETLQPSVWFGGRE
HVLMFAKLALYPCASLLAFASTCLLSRFSVGIFHLMQIAVPCAFLLLRLL
VGLALATL
Ligand information
Ligand IDA1AA3
InChIInChI=1S/C16H14N4/c17-13-4-6-19-15(9-13)11-2-1-3-12(8-11)16-10-14(18)5-7-20-16/h1-10H,(H2,17,19)(H2,18,20)
InChIKeyXLXGLQRJMSGVPH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Nc1ccnc(c1)c2cccc(c2)c3cc(N)ccn3
OpenEye OEToolkits 2.0.7c1cc(cc(c1)c2cc(ccn2)N)c3cc(ccn3)N
ACDLabs 12.01Nc1cc(ncc1)c1cc(ccc1)c1cc(N)ccn1
FormulaC16 H14 N4
Name(2P,2'P)-2,2'-(1,3-phenylene)di(pyridin-4-amine)
ChEMBL
DrugBank
ZINC
PDB chain8vic Chain A Residue 601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8vic Structure of human TMEM175 in an inhibitor-bound state
Resolution3.48 Å
Binding residue
(original residue number in PDB)		L53 H57 D279 E282
Binding residue
(residue number reindexed from 1)		L24 H28 D164 E167
Annotation score1
External links
PDB RCSB:8vic, PDBe:8vic, PDBj:8vic
PDBsum8vic
PubMed
UniProtQ9BSA9|TM175_HUMAN Endosomal/lysosomal proton channel TMEM175 (Gene Name=TMEM175)

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