Structure of PDB 5xwi Chain A Binding Site BS03

Receptor Information
>5xwi Chain A (length=503) Species: 28214 (Sphingomonas sp.) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PAARSIAATPPKLIVAISVDQFSADLFSEYRQYYTGGLKRLTSEGAVFPR
GYQSHAATETCPGHSTILTGSRPSRTGIIANNWFDLDAKREDKNLYCAED
ESQPGSSSDKYEASPLHLKVPTLGGRMKAANPATRVVSVAGKDRAAIMMG
GATADQVWWLGGPQGYVSYKGVAPTPLVTQVNQAFAQRLAQPNPGFELPA
QCVSKDFPVQAGNRTVGTGRFARDAGDYKGFRISPEQDAMTLAFAAAAIE
NMQLGKQAQTDIISIGLSATDYVGHTFGTEGTESCIQVDRLDTELGAFFD
KLDKDGIDYVVVLTADHGGHDLPERHRMNAMPMEQRVDMALTPKALNATI
VIWSDGPSGDIYYDALKYLRAHPQVQTVFTKAEIAATPSPSGPPESWSLI
QEARASFYPSRSGDLLLLLKPRVMSIPEQAVMGSVATHGSPWDTDRRVPI
LFWRKGMQHFEQPLGVETVDILPSLAALIKLPVPKDQIDGRCLDLVAGKD
DSC
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 chain5xwi Chain A Residue 603 [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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PDB5xwi Crystal Structure of SPAP, an alkaline phosphatase from Sphingomonas showing covalent intermediate
Resolution1.872 Å
Binding residue
(original residue number in PDB)		D547 V549 G551 D553
Binding residue
(residue number reindexed from 1)		D494 V496 G498 D500
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.1: alkaline phosphatase.
Gene Ontology
Molecular Function
GO:0004035 alkaline phosphatase activity

View graph for
Molecular Function
External links
PDB RCSB:5xwi, PDBe:5xwi, PDBj:5xwi
PDBsum5xwi
PubMed
UniProtA1YYW7|ALPH_SPHSX Alkaline phosphatase PhoK (Gene Name=phoK)

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