Structure of PDB 5nna Chain D Binding Site BS02

Receptor Information
>5nna Chain D (length=264) Species: 187304 (Roseibium aggregatum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SHHHHHHASSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCAR
FRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDE
IPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLM
RTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTD
AGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKN
GTGSPLRVLAMVTE
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain5nna Chain D Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5nna A fundamental catalytic difference between zinc and manganese dependent enzymes revealed in a bacterial isatin hydrolase.
Resolution1.5 Å
Binding residue
(original residue number in PDB)		H69 H73 D75 Q219
Binding residue
(residue number reindexed from 1)		H76 H80 D82 Q226
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004061 arylformamidase activity
GO:0046872 metal ion binding
Biological Process
GO:0019441 tryptophan catabolic process to kynurenine

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Molecular Function
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Biological Process
External links
PDB RCSB:5nna, PDBe:5nna, PDBj:5nna
PDBsum5nna
PubMed30166577
UniProtA0P0F0

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