Structure of PDB 6w12 Chain A Binding Site BS01

Receptor Information
>6w12 Chain A (length=129) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SCPVNWVEHQDSCYWFSHSGMSWAEAEKYCQLKNAHLVVINSREEQNFVQ
KYLGSAYTWMGLSDPEGAWKWVDGTDYATGFQNWKPGQPDDWQGHGLGGG
EDCAHFHPDGRWNDDVCQRPYHWVCEAGL
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 chain6w12 Chain A Residue 401 [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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PDB6w12 Crystal Structure of the Carbohydrate Recognition Domain of the Human Macrophage Galactose C-Type Lectin Bound to GalNAc and the Tumor-Associated Tn Antigen.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		Q267 D269 E280 N292 D293
Binding residue
(residue number reindexed from 1)		Q88 D90 E101 N113 D114
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:6w12, PDBe:6w12, PDBj:6w12
PDBsum6w12
PubMed33724805
UniProtQ8IUN9|CLC10_HUMAN C-type lectin domain family 10 member A (Gene Name=CLEC10A)

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