PDB entry 3ura
View 3ura on RCSB PDB site
Description: Crystal Structure of PTE mutant H254G/H257W/L303T/K185R/I274N/A80V/S61T
Class: hydrolase
Keywords: metalloenzyme, TIM barrel, nerve agents, phosphotriesterase, HYDROLASE
Deposited on
2011-11-21, released
2012-08-01
The last revision prior to the SCOPe 2.02 freeze date was dated
2012-10-03, with a file datestamp of
2012-09-28.
Experiment type: XRAY
Resolution: 1.88 Å
R-factor: 0.232
AEROSPACI score: 0.44
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: Parathion hydrolase
Species: Brevundimonas diminuta [TaxId:293]
Gene: OPD
Database cross-references and differences (RAF-indexed):
- Uniprot P0A434 (0-326)
- engineered mutation (26)
- engineered mutation (45)
- engineered mutation (150)
- engineered mutation (219)
- engineered mutation (222)
- engineered mutation (239)
- engineered mutation (268)
Domains in SCOPe 2.02: d3uraa_ - Chain 'B':
Compound: Parathion hydrolase
Species: Brevundimonas diminuta [TaxId:293]
Gene: OPD
Database cross-references and differences (RAF-indexed):
- Uniprot P0A434 (Start-326)
- engineered mutation (26)
- engineered mutation (45)
- engineered mutation (150)
- engineered mutation (219)
- engineered mutation (222)
- engineered mutation (239)
- engineered mutation (268)
Domains in SCOPe 2.02: d3urab_ - Heterogens: IMD, CO, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence; same for both SEQRES and ATOM records: (download)
>3uraA (A:)
drintvrgpitiseagftlthehicgtsagflrawpeffgsrkalvekavrglrraraag
vrtivdvstfdigrdvsllaevsraadvhivaatglwfdpplsmrlrsveeltqfflrei
qygiedtgiragiikvattgkatpfqelvlraaaraslatgvpvtthtaasqrdgeqqaa
ifeseglspsrvcighsddtddlsyltalaargyligldgipwsaiglednasasallgn
rswqtrallikalidqgymkqilvsndwtfgfssyvtnimdvmdrvnpdgmafiplrvip
flrekgvpqetlagitvtnparflspt
- Chain 'B':
Sequence, based on SEQRES records: (download)
>3uraB (B:)
drintvrgpitiseagftlthehicgtsagflrawpeffgsrkalvekavrglrraraag
vrtivdvstfdigrdvsllaevsraadvhivaatglwfdpplsmrlrsveeltqfflrei
qygiedtgiragiikvattgkatpfqelvlraaaraslatgvpvtthtaasqrdgeqqaa
ifeseglspsrvcighsddtddlsyltalaargyligldgipwsaiglednasasallgn
rswqtrallikalidqgymkqilvsndwtfgfssyvtnimdvmdrvnpdgmafiplrvip
flrekgvpqetlagitvtnparflspt
Sequence, based on observed residues (ATOM records): (download)
>3uraB (B:)
rintvrgpitiseagftlthehicgtsagflrawpeffgsrkalvekavrglrraraagv
rtivdvstfdigrdvsllaevsraadvhivaatglwfdpplsmrlrsveeltqfflreiq
ygiedtgiragiikvattgkatpfqelvlraaaraslatgvpvtthtaasqrdgeqqaai
feseglspsrvcighsddtddlsyltalaargyligldgipwsainasasallgnrswqt
rallikalidqgymkqilvsndwtfgfssyvtnimdvmdrvnpdgmafiplrvipflrek
gvpqetlagitvtnparflspt