Structure of PDB 9en2 Chain A Binding Site BS02

Receptor Information
>9en2 Chain A (length=241) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ARPVFLCGGDVKGESGYVASEGFPNLYPPNKECIWTITVPEGQTVSLSFR
VFDLELHPACRYDALEVFAGSGTSGQRLGRFCGTFRPAPLVAPGNQVTLR
MTTDEGTGGRGFLLWYSGRATQFCGGRLEKAQGTLTTPNWPESDYPPGIS
CSWHIIAPPDQVIALTFEKFDLEPDTYCRYDSVSVFNGAVSDDSRRLGKF
CGDAVPGSISSEGNELLVQFVSDLSVTADGFSASYKTLPRG
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 chain9en2 Chain A Residue 302 [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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PDB9en2 Mono- and Bi-specific Nanobodies Targeting the CUB Domains of PCPE-1 Reduce the Proteolytic Processing of Fibrillar Procollagens.
Resolution2.2 Å
Binding residue
(original residue number in PDB)		E208 D216 D258 S260 V261
Binding residue
(residue number reindexed from 1)		E173 D181 D223 S225 V226
Annotation score4
External links
PDB RCSB:9en2, PDBe:9en2, PDBj:9en2
PDBsum9en2
PubMed38901640
UniProtQ15113|PCOC1_HUMAN Procollagen C-endopeptidase enhancer 1 (Gene Name=PCOLCE)

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