Structure of PDB 3umk Chain A Binding Site BS01

Receptor Information
>3umk Chain A (length=184) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DENEHAHFQKAKERLEAKHRERMSQVMREWEEAERQAKNLPKADKKAVIQ
HFQEKVESLEQEAANERQQLVETHMARVEAMLNDRRRLALENYITALQAV
PPRPRHVFNMLKKYVRAEQKDRQHTLKHFEHVRMVDPKKAAQIRSQVMTH
LRVIYERMNQSLSLLYNVPAVAEEIQDEVDELLQ
Ligand information
Ligand IDCU
InChIInChI=1S/Cu/q+2
InChIKeyJPVYNHNXODAKFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Cu+2]
CACTVS 3.341[Cu++]
FormulaCu
NameCOPPER (II) ION
ChEMBL
DrugBankDB14552
ZINC
PDB chain3umk Chain A Residue 1 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3umk Metal Binding Dictates Conformation and Function of the Amyloid Precursor Protein (APP) E2 Domain.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		H313 H382 H432 H436
Binding residue
(residue number reindexed from 1)		H5 H74 H124 H128
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Cellular Component
External links
PDB RCSB:3umk, PDBe:3umk, PDBj:3umk
PDBsum3umk
PubMed22245578
UniProtP05067|A4_HUMAN Amyloid-beta precursor protein (Gene Name=APP)

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