Structure of PDB 6ttd Chain A Binding Site BS01

Receptor Information
>6ttd Chain A (length=457) Species: 63363 (Aquifex aeolicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKQSLNIPGYSLFSDGQRVSITAKWTTLEVIPGKSTDMLVYEIDNEYNPV
IFLRKGQTFSADFVNNSGEDSIIHWHGFRAPWKSDGHPYYAVKDGETYSY
PDFTIIDRSGTYFYHPHPHGRTGYQVYYGLAGMIIIEDEDEDNLKQALDL
EYGVTDIPLIIQDKTFDSSGQLVYNPMGHMGFWGDTILVNLTPNPYMDVE
RKIYRFRILNGSNARPYRLALLRGNQRMRFWVIGVEGGLLDTPKEVNEIL
VAPGERIDILVDFRDASVNDVIKLYNFPHNLIMGMADNSEFEVMEFRVTK
DSAYDKSIPQRLSEVTPINTDGAQVQRITLGMRRMVFTINGETWEDGYAN
PQDINNPKVLFEQNNGDVVILEYVNNTGTYHPMHIHGFQFQVLERSLGPL
GATDLGWKDTVIVAPMETVRIAVDMSHPYNEHQIYLLHCHILEHHDEGMM
VNYRVNA
Ligand information
Ligand IDCU
InChIInChI=1S/Cu/q+2
InChIKeyJPVYNHNXODAKFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Cu+2]
CACTVS 3.341[Cu++]
FormulaCu
NameCOPPER (II) ION
ChEMBL
DrugBankDB14552
ZINC
PDB chain6ttd Chain A Residue 701 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6ttd Distal Mutations Shape Substrate-Binding Sites during Evolution of a Metallo-Oxidase into a Laccase
Resolution1.801 Å
Binding residue
(original residue number in PDB)		H451 C509 H514
Binding residue
(residue number reindexed from 1)		H381 C439 H444
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005507 copper ion binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
Biological Process
GO:0051301 cell division
Cellular Component
GO:0030288 outer membrane-bounded periplasmic space

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6ttd, PDBe:6ttd, PDBj:6ttd
PDBsum6ttd
PubMed
UniProtO67206

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