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2PW0

crystal structure of trans-aconitate bound to methylaconitate isomerase PrpF from Shewanella oneidensis

Functional Information from GO Data
ChainGOidnamespacecontents
A0016853molecular_functionisomerase activity
A0016863molecular_functionintramolecular oxidoreductase activity, transposing C=C bonds
A0019629biological_processpropionate catabolic process, 2-methylcitrate cycle
B0016853molecular_functionisomerase activity
B0016863molecular_functionintramolecular oxidoreductase activity, transposing C=C bonds
B0019629biological_processpropionate catabolic process, 2-methylcitrate cycle
Functional Information from PDB Data
site_idAC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO B 2045
ChainResidue
BILE144
BASN219
BALA220
BILE222
BPRO223
BHOH2080
BHOH2159

site_idAC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO A 2046
ChainResidue
ALYS348
AGLU349
AGLN365
AALA366
ATRP373
AALA333
AGLU347

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE EDO A 2047
ChainResidue
AASN219
AALA220
APRO223
AHOH2066
AHOH2124

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO A 2048
ChainResidue
AGLU166
AASP168
AARG352
AHOH2193

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO B 2049
ChainResidue
BPRO33
BGLU34
BHOH2112
BHOH2228

site_idAC6
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO B 2050
ChainResidue
BALA333
BGLU347
BLYS348
BGLU349
BALA364
BGLN365
BALA366

site_idAC7
Number of Residues17
DetailsBINDING SITE FOR RESIDUE TRC A 2001
ChainResidue
ASER22
ASER69
ASER70
ALYS73
ACYS107
AASN109
AHIS278
ALYS281
ASER312
AMET313
AHIS317
AMET321
AGLY322
AHOH2511
AHOH2512
AHOH2513
AHOH2514

site_idAC8
Number of Residues13
DetailsBINDING SITE FOR RESIDUE TRC B 2002
ChainResidue
BSER22
BSER69
BSER70
BLYS73
BASN109
BLYS281
BHIS317
BMET321
BGLY322
BHOH2457
BHOH2459
BHOH2460
BHOH2461

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsACT_SITE: Proton donor/acceptor => ECO:0000305|PubMed:17567742
ChainResidueDetails
ACYS107
AMET321
BCYS107
BMET321

site_idSWS_FT_FI2
Number of Residues14
DetailsBINDING: BINDING => ECO:0000269|PubMed:17567742
ChainResidueDetails
ASER22
BLYS281
BSER312
BHIS317
BGLY322
ASER69
AASN109
ALYS281
ASER312
AHIS317
AGLY322
BSER22
BSER69
BASN109

site_idSWS_FT_FI3
Number of Residues2
DetailsMOD_RES: Cysteine sulfinic acid (-SO2H) => ECO:0000269|PubMed:17567742
ChainResidueDetails
ACYS107
BCYS107

219869

PDB entries from 2024-05-15

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