Structure of PDB 5e1r Chain A Binding Site BS01

Receptor Information
>5e1r Chain A (length=357) Species: 32201 (Carya illinoinensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HNPYYFHSQGLRSRHESGEGEVKYLERFTERTELLRGIENYRVVILEANP
NTFVLPYHKDAESVIVVTRGRATLTFVSQERRESFNLEYGDVIRVPAGAT
EYVINQDSNERLEMVKLLQPVNNPGQFREYYAAGAQSTESYLRVFSNDIL
VAALNTPRDRLERFFDQQEQREGVIIRASQEKLRALSGPISLKSQRSSYS
NQFGQFFEACPEEHRQLQEMDVLVNYAEIKRGAMMVPHYNSKATVVVYVV
EGTGRFEMACPHDQFQKVTARLARGDIFVIPAGHPIAITASQNENLRLVG
FGINGKNNQRNFLAGQNNIINQLEREAKELSFNMPREEIEEIFERQVESY
FVPMERQ
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 chain5e1r Chain A Residue 801 [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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PDB5e1r Identification and Characterization of a New Pecan [Carya illinoinensis (Wangenh.) K. Koch] Allergen, Car i 2.
Resolution2.651 Å
Binding residue
(original residue number in PDB)		Y379 C652 H654 H698
Binding residue
(residue number reindexed from 1)		Y4 C260 H262 H284
Annotation score3
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5e1r, PDBe:5e1r, PDBj:5e1r
PDBsum5e1r
PubMed27128197
UniProtB3STU4|VCL_CARIL Vicilin Car i 2.0101 (Gene Name=pec2a1a)

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