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3KV7

Structural basis of the activity and substrate specificity of the fluoroacetyl-CoA thioesterase FlK - wild type FlK in complex with acetate

Functional Information from GO Data
ChainGOidnamespacecontents
A0016289molecular_functionacyl-CoA hydrolase activity
A0016787molecular_functionhydrolase activity
A0042803molecular_functionprotein homodimerization activity
B0016289molecular_functionacyl-CoA hydrolase activity
B0016787molecular_functionhydrolase activity
B0042803molecular_functionprotein homodimerization activity
Functional Information from PDB Data
site_idAC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ACT A 140
ChainResidue
APHE40
AALA41
ATHR42
AHOH214
BGLU50
BGLY69
BACT140

site_idAC2
Number of Residues8
DetailsBINDING SITE FOR RESIDUE ACT A 141
ChainResidue
AARG120
AHOH362
AHOH411
BPHE33
BPHE36
BACT142
AGLU50
AGLY69

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ACT A 142
ChainResidue
ALEU68
AGLY69
BHIS76
BALA78
BALA79
BACT142

site_idAC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ACT B 140
ChainResidue
AHIS76
AALA78
AACT140
BLEU68
BGLY69
BHOH213

site_idAC5
Number of Residues9
DetailsBINDING SITE FOR RESIDUE ACT B 141
ChainResidue
BALA71
BARG93
BSER94
BARG99
BARG99
BSER101
BGLU119
BGLU119
BHOH247

site_idAC6
Number of Residues9
DetailsBINDING SITE FOR RESIDUE ACT B 142
ChainResidue
AACT141
AACT142
AHOH362
AHOH411
BVAL23
BVAL39
BPHE40
BALA41
BTHR42

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ACT B 143
ChainResidue
AALA71
AILE72
ACYS73
AHOH158
BVAL74
BARG103

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues6
DetailsACT_SITE:
ChainResidueDetails
ATHR42
AGLU50
AHIS76
BTHR42
BGLU50
BHIS76

site_idSWS_FT_FI2
Number of Residues4
DetailsBINDING:
ChainResidueDetails
APHE40
AHIS76
BPHE40
BHIS76

site_idSWS_FT_FI3
Number of Residues4
DetailsBINDING: BINDING => ECO:0000269|PubMed:20430898, ECO:0000269|PubMed:20836570
ChainResidueDetails
AGLY69
AARG120
BGLY69
BARG120

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PDB entries from 2024-07-24

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