PDB entry 3i2g

View 3i2g on RCSB PDB site
Description: Cocaine Esterase with mutation G173Q, bound to DTT adduct
Class: hydrolase
Keywords: alpha/beta hydrolase, Hydrolase
Deposited on 2009-06-29, released 2010-06-16
The last revision prior to the SCOPe 2.08 freeze date was dated 2017-11-01, with a file datestamp of 2017-10-27.
Experiment type: XRAY
Resolution: 2.5 Å
R-factor: N/A
AEROSPACI score: 0.21 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: cocaine esterase
    Species: Rhodococcus sp. MB1 'Bresler 1999' [TaxId:104109]
    Gene: Cocaine Esterase, cocE
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9L9D7 (Start-573)
      • engineered (172)
      • expression tag (574)
    Domains in SCOPe 2.08: d3i2ga1, d3i2ga2, d3i2ga3
  • Heterogens: CL, DBC, GOL, SO4, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3i2gA (A:)
mvdgnysvasnvmvpmrdgvrlavdlyrpdadgpvpvllvrnpydkfdvfawstqstnwl
efvrdgyavviqdtrglfasegefvphvddeadaedtlswileqawcdgnvgmfgvsylg
vtqwqaavsgvgglkaiapsmasadlyrapwygpggalsveallgwsaligtqlitsrsd
arpedaadfvqlaailndvagaasvtplaeqpllgrlipwvidqvvdhpdndeswqsisl
ferlgglatpalitagwydgfvgeslrtfvavkdnadarlvvgpwshsnltgrnadrkfg
iaatypiqeattmhkaffdrhlrgetdalagvpkvrlfvmgidewrdetdwplpdtaytp
fylggsgaantstgggtlstsisgtesadtylydpadpvpslggtllfhngdngpadqrp
ihdrddvlcystevltdpvevtgtvsarlfvsssavdtdftaklvdvfpdgraialcdgi
vrmryretlvnptlieageiyevaidmlatsnvflpghrimvqvsssnfpkydrnsntgg
viareqleemctavnrihrgpehpshivlpiikrklaaalehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >3i2gA (A:)
vdgnysvasnvmvpmrdgvrlavdlyrpdadgpvpvllvrnpydkfdvfawstqstnwle
fvrdgyavviqdtrglfasegefvphvddeadaedtlswileqawcdgnvgmfgvsylgv
tqwqaavsgvgglkaiapsmasadlyrapwygpggalsveallgwsaligtqlitsrsda
rpedaadfvqlaailndvagaasvtplaeqpllgrlipwvidqvvdhpdndeswqsislf
erlgglatpalitagwydgfvgeslrtfvavkdnadarlvvgpwshsnltgrnadrkfgi
aatypiqeattmhkaffdrhlrgetdalagvpkvrlfvmgidewrdetdwplpdtaytpf
ylggsgaantstgggtlstsisgtesadtylydpadpvpslggtllfhngdngpadqrpi
hdrddvlcystevltdpvevtgtvsarlfvsssavdtdftaklvdvfpdgraialcdgiv
rmryretlvnptlieageiyevaidmlatsnvflpghrimvqvsssnfpkydrnsntggv
iareqleemctavnrihrgpehpshivlpiikrk