Structure of PDB 8ted Chain B Binding Site BS01

Receptor Information
>8ted Chain B (length=511) Species: 376686 (Flavobacterium johnsoniae UW101) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DKIRILWVDDEIDLLKPHILFLEKKNYEVTTSNNGLDAIALFEEENFDIV
FLDENMPGMSGLETLSEMKEKKSAIPMIMITKSEEEYIMEEAIGSKIADY
LIKPVNPNQILLSLKKNLDDSRLITEKTTLDYQKEFRKISMELAMVNSYE
DWVELYKKLLFWELKLEDINDQAMIEILESQKVEANSQFGKYIERNYEDW
FAPKADKPIQSHNLFKELVVPEIKKKDKPILFVVIDNLRYDQWKSFETVI
SNYYKLEKEVPYFSILPTATQYARNAIFSGLMPLDMEKQFPQYWKNDVED
GGKNLYEAEFLSAQIKRLGLNIKEDYFKITNYAGGKKLAENFKALKGNDL
VTVVYNFVDMLSHAKTEMEVVKELASDDKAYRSLTLSWFKNSPLLEIIQQ
AQLLGFKLILTTDHGTINVKNPSKVVGLNLRYKTGRSLTYEQKDVYVVKE
PKTIGLPAINMSSSFIFAKNDFFLAYVNNYNHYVSYYKNTYQHGGISLEE
MIIPFLVFNPK
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 chain8ted Chain B Residue 613 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8ted PorX primitive orthorhombic crystal form
Resolution2.1 Å
Binding residue
(original residue number in PDB)		D237 N238 T271 D414 H415
Binding residue
(residue number reindexed from 1)		D236 N237 T270 D413 H414
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
Biological Process
GO:0000160 phosphorelay signal transduction system

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Molecular Function
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Biological Process
External links
PDB RCSB:8ted, PDBe:8ted, PDBj:8ted
PDBsum8ted
PubMed
UniProtA5FFU4

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