PDB entry 4qda

View 4qda on RCSB PDB site
Description: Crystal structure of mutant Thioesterase PA1618 (E64A) from Pseudomonas aeruginosa
Class: hydrolase
Keywords: Hotdog Fold, Thioesterase, Coenzyme A, acyl carrier protein, cytosol, HYDROLASE
Deposited on 2014-05-13, released 2015-05-13
The last revision prior to the SCOPe 2.08 freeze date was dated 2017-11-22, with a file datestamp of 2017-11-17.
Experiment type: XRAY
Resolution: 2.3 Å
R-factor: N/A
AEROSPACI score: 0.24 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Thioesterase PA1618
    Species: Pseudomonas aeruginosa [TaxId:208964]
    Gene: PA1618
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9I3A4
      • engineered mutation (63)
    Domains in SCOPe 2.08: d4qdaa_
  • Chain 'B':
    Compound: Thioesterase PA1618
    Species: Pseudomonas aeruginosa [TaxId:208964]
    Gene: PA1618
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9I3A4
      • engineered mutation (63)
    Domains in SCOPe 2.08: d4qdab_
  • Chain 'C':
    Compound: Thioesterase PA1618
    Species: Pseudomonas aeruginosa [TaxId:208964]
    Gene: PA1618
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9I3A4
      • engineered mutation (63)
    Domains in SCOPe 2.08: d4qdac_
  • Chain 'D':
    Compound: Thioesterase PA1618
    Species: Pseudomonas aeruginosa [TaxId:208964]
    Gene: PA1618
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9I3A4
      • engineered mutation (63)
    Domains in SCOPe 2.08: d4qdad_
  • Chain 'E':
    Compound: Thioesterase PA1618
    Species: Pseudomonas aeruginosa [TaxId:208964]
    Gene: PA1618
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9I3A4
      • engineered mutation (63)
    Domains in SCOPe 2.08: d4qdae_
  • Chain 'F':
    Compound: Thioesterase PA1618
    Species: Pseudomonas aeruginosa [TaxId:208964]
    Gene: PA1618
    Database cross-references and differences (RAF-indexed):
    • Uniprot Q9I3A4
      • engineered mutation (63)
    Domains in SCOPe 2.08: d4qdaf_
  • Heterogens: HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4qdaA (A:)
mslwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasv
vlaaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirl
sgddgkpsciarltmavvplagralehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4qdaA (A:)
slwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasvv
laaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirls
gddgkpsciarltmavvpl

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4qdaB (B:)
mslwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasv
vlaaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirl
sgddgkpsciarltmavvplagralehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4qdaB (B:)
slwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasvv
laaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirls
gddgkpsciarltmavvpl

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >4qdaC (C:)
mslwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasv
vlaaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirl
sgddgkpsciarltmavvplagralehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4qdaC (C:)
slwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasvv
laaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirls
gddgkpsciarltmavvpl

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >4qdaD (D:)
mslwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasv
vlaaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirl
sgddgkpsciarltmavvplagralehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4qdaD (D:)
slwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasvv
laaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirls
gddgkpsciarltmavvpl

  • Chain 'E':
    Sequence, based on SEQRES records: (download) 
    >4qdaE (E:)
mslwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasv
vlaaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirl
sgddgkpsciarltmavvplagralehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4qdaE (E:)
slwrqtpdleqlnasqknsigdllgirfeafddesltasmpvhggasvvlaaslgsmasy
lcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirlsgddgkpsciar
ltmavvpl

  • Chain 'F':
    Sequence, based on SEQRES records: (download) 
    >4qdaF (F:)
mslwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthqpfgllhggasv
vlaaslgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirl
sgddgkpsciarltmavvplagralehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >4qdaF (F:)
slwrqtpdleqlnasqknsigdllgirfeafddesltasmpvdsrthllhggasvvlaas
lgsmasylcvdtsqyycvglevnanhlrglrsgrvtavaraihlgrtthvwdirlsgddg
kpsciarltmavvpl