Structure of PDB 5s8c Chain A Binding Site BS01
Receptor Information
>5s8c Chain A (length=118) Species:
9606
(Homo sapiens) [
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YDIQAWKKQCEELLNLIFQCEDSEPFRQPVDLLEYPDYRDIIDTPMDFAT
VRETLEAGNYESPMELCKDVRLIFSNSKAYTPSKRSRIYSMSLRLSAFFE
EHISSVLSDYKSALRFHK
Ligand information
Ligand ID
RYD
InChI
InChI=1S/C8H9N3O/c1-11-8-3-2-6(5-12)4-7(8)9-10-11/h2-4,12H,5H2,1H3
InChIKey
HVLCKOBNGNRDPT-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.385
Cn1nnc2cc(CO)ccc12
OpenEye OEToolkits 2.0.6
Cn1c2ccc(cc2nn1)CO
Formula
C8 H9 N3 O
Name
(1-methylbenzotriazol-5-yl)methanol
ChEMBL
DrugBank
ZINC
ZINC000000158987
PDB chain
5s8c Chain A Residue 1501 [
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Receptor-Ligand Complex Structure
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PDB
5s8c
XChem group deposition
Resolution
1.25 Å
Binding residue
(original residue number in PDB)
Y1350 S1392 Y1395 P1397 S1401 I1403
Binding residue
(residue number reindexed from 1)
Y35 S77 Y80 P82 S86 I88
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:5s8c
,
PDBe:5s8c
,
PDBj:5s8c
PDBsum
5s8c
PubMed
UniProt
Q8WWQ0
|PHIP_HUMAN PH-interacting protein (Gene Name=PHIP)
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