Structure of PDB 6ai0 Chain B Binding Site BS01

Receptor Information
>6ai0 Chain B (length=335) Species: 99287 (Salmonella enterica subsp. enterica serovar Typhimurium str. LT2) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QLEDSLGMEVGYRLIPMVDFQQDGELLGRIRSIRKKFAQDMGFLPPVVHI
RDNMDLQPARYRILMKGVEIGSGDAYPGRWLAINPGTAAGTLPGEKTVDP
AFGLDAIWIESALKEQAQIQGFTVVEASTVVATHLNHLIGQFSAELFGRQ
EAQQLLDRVSQEMPKLTEDLVPGVVTLTTLHKVLQNLLAEKVPIRDMRTI
LETLAEHAPLQSDPHELTAVVRVALGRAITQQWFPGNEEVQVIGLDTALE
RLLLQALQGGGGLEPGLADRLLAQTQEALSRQEMLGAPPVLLVNHALRPL
LSRFLRRSLPQLVVLSNLELSDNRHIRMTATIGGK
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 chain6ai0 Chain B Residue 802 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6ai0 Structural Insights into the Substrate Specificity Switch Mechanism of the Type III Protein Export Apparatus.
Resolution2.4 Å
Binding residue
(original residue number in PDB)		N674 L677 S678 D679
Binding residue
(residue number reindexed from 1)		N317 L320 S321 D322
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0009306 protein secretion
Cellular Component
GO:0016020 membrane

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Biological Process
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Cellular Component
External links
PDB RCSB:6ai0, PDBe:6ai0, PDBj:6ai0
PDBsum6ai0
PubMed31031200
UniProtP40729|FLHA_SALTY Flagellar biosynthesis protein FlhA (Gene Name=flhA)

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