Structure of PDB 6puv Chain A Binding Site BS01

Receptor Information
>6puv Chain A (length=121) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SCPVNWVEHQDSCYWFSHSGMSWAEAEKYCQLKNAHLVVINSREEQNFVQ
KYLGSAYTWMGLSDPEGAWKWVDGTDYATGFQNWKPGQPDDWEDCAHFHP
DGRWNDDVCQRPYHWVCEAGL
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 chain6puv Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6puv Crystal Structure of the Carbohydrate Recognition Domain of the Human Macrophage Galactose C-Type Lectin Bound to GalNAc and the Tumor-Associated Tn Antigen.
Resolution1.2 Å
Binding residue
(original residue number in PDB)		V40 N42 E46 E127
Binding residue
(residue number reindexed from 1)		V39 N41 E45 E118
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:6puv, PDBe:6puv, PDBj:6puv
PDBsum6puv
PubMed33724805
UniProtQ8IUN9|CLC10_HUMAN C-type lectin domain family 10 member A (Gene Name=CLEC10A)

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