Structure of PDB 1ajj Chain A Binding Site BS01

Receptor Information
>1ajj Chain A (length=37) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PCSAFEFHCLSGECIHSSWRCDGGPDCKDKSDEENCA
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain1ajj Chain A Residue 73 [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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PDB1ajj Molecular basis of familial hypercholesterolaemia from structure of LDL receptor module.
Resolution1.7 Å
Binding residue
(original residue number in PDB)		W22 D25 G27 D29 D35 E36
Binding residue
(residue number reindexed from 1)		W19 D22 G24 D26 D32 E33
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:1ajj, PDBe:1ajj, PDBj:1ajj
PDBsum1ajj
PubMed9262405
UniProtP01130|LDLR_HUMAN Low-density lipoprotein receptor (Gene Name=LDLR)

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