Structure of PDB 1kdm Chain A Binding Site BS01

Receptor Information
>1kdm Chain A (length=177) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DPPAVHLSNGPGQEPIAVMTFDLTKITKTSSSFEVRTWDPEGVIFYGDTN
PKDDWFMLGLRDGRPEIQLHNHWAQLTVGAGPRLDDGRWHQVEVKMEGDS
VLLEVDGEEVLRLRQVSGPLTSKRHPIMRIALGGLLFPASNLRLPLVPAL
DGCLRRDSWLDKQAEISASAPTSLRSC
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 chain1kdm Chain A Residue 350 [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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PDB1kdm Resolution of a disordered region at the entrance of the human sex hormone-binding globulin steroid-binding site.
Resolution2.35 Å
Binding residue
(original residue number in PDB)		D50 E52 A160
Binding residue
(residue number reindexed from 1)		D39 E41 A149
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:1kdm, PDBe:1kdm, PDBj:1kdm
PDBsum1kdm
PubMed12054810
UniProtP04278|SHBG_HUMAN Sex hormone-binding globulin (Gene Name=SHBG)

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