Structure of PDB 5vni Chain B Binding Site BS02

Receptor Information
>5vni Chain B (length=727) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LRVVNLLQERNMLPSTPLKPPVPNLHEDIQKLNCNPELFRCTLTSIPQTQ
ALLNKAKLPLGLLLHPFKDLVQLPVVTSSTIVRCRSCRTYINPFVSFLDQ
RRWKCNLCYRVNDVPEEEPHRRPEVQNATIEFMAPSEYMLRPPQPPVYLF
VFDVSHNAVETGYLNSVCQSLLDNLDLLPGNTRTKIGFITFDSTIHFYGL
QESLSQPQMLIVSDIEDVFIPMPENLLVNLNESKELVQDLLKTLPQMFTK
TLETQSALGPALQAAFKLMSPTGGRMSVFQTQLPTLGVGALKPREEPNHR
SSAKMTPSTDFYKKLALDCSGQQVAVDLFLLSGQYSDLASLGCISRYSAG
SVYYYPSYHHQHNPVQVQKLQKELQRYLTRKIGFEAVMRIRCTKGLSIHT
FHGNFFVRSTDLLSLPNVNPDAGYAVQMSVEESLTDTQLVSFQSALLYTS
SKGERRIRVHTLCLPVVSTLNDVFLGADVQAISGLLANMAVDRSMTASLS
DARDALVNAVIDSLSAYRSSVPGLMVPFSLRLFPLFVLALLKQKSFQTGT
NARLDERIFAMCQVKNQPLVYLMLTTHPSLYRVDNLSDEGALNISDRTIP
QPPILQLSVEKLSRDGAFLMDAGSVLMLWVGKNCTQNFLSQVLGVQNYAS
IPQPMTDLPELDTPESARIIAFISWLREQRPFFPILYVIADESPMKANFL
QNMIEDRTESALSYYEFLLHIQQQVNK
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5vni Chain B Residue 1101 [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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PDB5vni ER retention is imposed by COPII protein sorting and attenuated by 4-phenylbutyrate.
Resolution2.788 Å
Binding residue
(original residue number in PDB)		C431 C452 C455
Binding residue
(residue number reindexed from 1)		C84 C105 C108
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008270 zinc ion binding
Biological Process
GO:0006886 intracellular protein transport
GO:0006888 endoplasmic reticulum to Golgi vesicle-mediated transport
Cellular Component
GO:0030127 COPII vesicle coat

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5vni, PDBe:5vni, PDBj:5vni
PDBsum5vni
PubMed28594326
UniProtO95486|SC24A_HUMAN Protein transport protein Sec24A (Gene Name=SEC24A)

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