Structure of PDB 6tm2 Chain F Binding Site BS02

Receptor Information
>6tm2 Chain F (length=90) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
CCLWSDWINEDHPSSGSDDGDRETFDGVCGAPEDIECRSVKDPHLSLEQH
GQKVQCDVSVGFICKNEDQFGNGPFGLCYDYKIRVNCCWP
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 chain6tm2 Chain F Residue 1502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6tm2 Assembly Mechanism of Mucin and von Willebrand Factor Polymers.
Resolution2.95 Å
Binding residue
(original residue number in PDB)		D1312 H1313 S1316 G1317 D1319 G1321
Binding residue
(residue number reindexed from 1)		D11 H12 S15 G16 D18 G20
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:6tm2, PDBe:6tm2, PDBj:6tm2
PDBsum6tm2
PubMed33031746
UniProtQ02817|MUC2_HUMAN Mucin-2 (Gene Name=MUC2)

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