Structure of PDB 5xtw Chain H Binding Site BS01

Receptor Information
>5xtw Chain H (length=441) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TRQFLIYNEDHKRCVDAVSPSAVQTAACNQDAESQKFRWVSESQIMSVAF
KLCLGVPSKTDWVAITLYACDSKSEFQKWECKNDTLLGIKGEDLFFNYGN
RQEKNIMLYKGSGLWSRWKIYGTTDNLCSRGYEAMYTLLGNANGATCAFP
FKFENKWYADCTSAGRSDGWLWCGTTTDYDTDKLFGYCPLKFEGSESLWN
KDPLTSVSYQINSKSALTWHQARKSCQQQNAELLSITEIHEQTYLTGLTS
SLTSGLWIGLNSLSFNSGWQWSDRSPFRYLNWLPGSPSAEPGKSCVSLNP
GKNAKWENLECVQKLGYICKKWPYAGHCYKIHRDEKKIQRDALTTCRKEG
GDLTSIHTIEELDFIISQLGYEPNDELWIGLNDIKIQMYFEWSDGTPVTF
TKWLRGEPSHEQEDCVVMKGKDGYWADRGCEWPLGYICKMK
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 chain5xtw Chain H Residue 502 [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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PDB5xtw Structural Insights into the pH-Dependent Conformational Change and Collagen Recognition of the Human Mannose Receptor
Resolution3.2 Å
Binding residue
(original residue number in PDB)		E452 S454 E461 D475
Binding residue
(residue number reindexed from 1)		E407 S409 E413 D427
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5xtw, PDBe:5xtw, PDBj:5xtw
PDBsum5xtw
PubMed29225077
UniProtP22897|MRC1_HUMAN Macrophage mannose receptor 1 (Gene Name=MRC1)

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