Structure of PDB 1fif Chain B Binding Site BS03

Receptor Information
>1fif Chain B (length=154) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AIEVKLANMEAEINTLKSKLELTNKLHAFSMGKKSGKKFFVTNHERMPFS
KVKALCSELRGTVAIPRNAEENKAIQEVAKTSAFLGITDEVTEGQFMYVT
GGRLTYSNWKKDQPDDWYGHGLGGGEDCVHIVDNGLWNDDSCQRPYTAVC
EFPA
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 chain1fif Chain B Residue 3 [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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PDB1fif Mechanism of pH-dependent N-acetylgalactosamine binding by a functional mimic of the hepatocyte asialoglycoprotein receptor.
Resolution1.95 Å
Binding residue
(original residue number in PDB)		E165 D199
Binding residue
(residue number reindexed from 1)		E93 D127
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:1fif, PDBe:1fif, PDBj:1fif
PDBsum1fif
PubMed10931846
UniProtP19999|MBL1_RAT Mannose-binding protein A (Gene Name=Mbl1)

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