Structure of PDB 5nl5 Chain B Binding Site BS01

Receptor Information
>5nl5 Chain B (length=72) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MQIFVKTLTGKTITLVVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQL
EDGRTLSDYNIQKESTLHLVLR
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 chain5nl5 Chain B Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5nl5 Aggregation Pathways of Native-Like Ubiquitin Promoted by Single-Point Mutation, Metal Ion Concentration, and Dielectric Constant of the Medium.
Resolution1.96 Å
Binding residue
(original residue number in PDB)		K6 H68
Binding residue
(residue number reindexed from 1)		K6 H68
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5nl5, PDBe:5nl5, PDBj:5nl5
PDBsum5nl5
PubMed29266436
UniProtP0CG47|UBB_HUMAN Polyubiquitin-B (Gene Name=UBB)

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