Structure of PDB 1k1e Chain L Binding Site BS01

Receptor Information
>1k1e Chain L (length=170) Species: 71421 (Haemophilus influenzae Rd KW20) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KLENIKFVITDVDGVLTDGQLHYDANGEAIKSFHVRDGLGIKMLMDADIQ
VAVLSGRDSPILRRRIADLGIKLFFLGKLEKETACFDLMKQAGVTAEQTA
YIGDDSVDLPAFAACGTSFAVADAPIYVKNAVDHVLSTHGGKGAFREMSD
MILQAQGKSSVFDTAQGFLK
Ligand information
Ligand IDCO
InChIInChI=1S/Co/q+2
InChIKeyXLJKHNWPARRRJB-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Co+2]
CACTVS 3.341[Co++]
FormulaCo
NameCOBALT (II) ION
ChEMBL
DrugBankDB14205
ZINC
PDB chain1k1e Chain L Residue 212 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1k1e From structure to function: YrbI from Haemophilus influenzae (HI1679) is a phosphatase.
Resolution1.67 Å
Binding residue
(original residue number in PDB)		D14 D16 D107
Binding residue
(residue number reindexed from 1)		D11 D13 D104
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.45: 3-deoxy-manno-octulosonate-8-phosphatase.
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0016788 hydrolase activity, acting on ester bonds
GO:0019143 3-deoxy-manno-octulosonate-8-phosphatase activity
GO:0046872 metal ion binding
Biological Process
GO:0009103 lipopolysaccharide biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:1k1e, PDBe:1k1e, PDBj:1k1e
PDBsum1k1e
PubMed11835514
UniProtP45314|KDSC_HAEIN 3-deoxy-D-manno-octulosonate 8-phosphate phosphatase KdsC (Gene Name=HI_1679)

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