PDB entry 4aj1

View 4aj1 on RCSB PDB site
Description: rat LDHA in complex with N-(2-(methylamino)-1,3-benzothiazol-6-yl) acetamide
Class: oxidoreductase/inhibitor
Keywords: oxidoreductase-inhibitor complex, fragment based lead generated inhibitors
Deposited on 2012-02-15, released 2012-03-21
The last revision prior to the SCOPe 2.03 freeze date was dated 2012-04-25, with a file datestamp of 2012-04-20.
Experiment type: XRAY
Resolution: 1.87 Å
R-factor: 0.17629
AEROSPACI score: 0.5 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: L-lactate dehydrogenase A chain
    Species: Rattus norvegicus [TaxId:10116]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.03: d4aj1a1, d4aj1a2
  • Chain 'B':
    Compound: L-lactate dehydrogenase A chain
    Species: Rattus norvegicus [TaxId:10116]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.03: d4aj1b1, d4aj1b2
  • Chain 'C':
    Compound: L-lactate dehydrogenase A chain
    Species: Rattus norvegicus [TaxId:10116]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.03: d4aj1c1, d4aj1c2
  • Chain 'D':
    Compound: L-lactate dehydrogenase A chain
    Species: Rattus norvegicus [TaxId:10116]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.03: d4aj1d1, d4aj1d2
  • Heterogens: GOL, AJ1, MLI, OXM, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4aj1A (A:)
aalkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkge
mmdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfii
pnvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvh
plschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayev
iklkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngis
dvvkvtltpdeearlkksadtlwgiqkelqf

    Sequence, based on observed residues (ATOM records): (download) 
    >4aj1A (A:)
aalkdqlivnllkvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkgemmd
lqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfiipnv
vkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvhpls
chgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayevikl
kgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngisdvv
kvtltpdeearlkksadtlwgiqkelqf

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4aj1B (B:)
aalkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkge
mmdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfii
pnvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvh
plschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayev
iklkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngis
dvvkvtltpdeearlkksadtlwgiqkelqf

    Sequence, based on observed residues (ATOM records): (download) 
    >4aj1B (B:)
alkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkgem
mdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfiip
nvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvhp
lschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayevi
klkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngisd
vvkvtltpdeearlkksadtlwgiqkelqf

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >4aj1C (C:)
aalkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkge
mmdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfii
pnvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvh
plschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayev
iklkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngis
dvvkvtltpdeearlkksadtlwgiqkelqf

    Sequence, based on observed residues (ATOM records): (download) 
    >4aj1C (C:)
alkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkgem
mdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfiip
nvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvhp
lschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayevi
klkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngisd
vvkvtltpdeearlkksadtlwgiqkelqf

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >4aj1D (D:)
aalkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkge
mmdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfii
pnvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvh
plschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayev
iklkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngis
dvvkvtltpdeearlkksadtlwgiqkelqf

    Sequence, based on observed residues (ATOM records): (download) 
    >4aj1D (D:)
alkdqlivnllkeeqvpqnkitvvgvgavgmacaisilmkdladelalvdviedklkgem
mdlqhgslflktpkivsskdysvtansklviitagarqqegesrlnlvqrnvnifkfiip
nvvkyspqckllivsnpvdiltyvawkisgfpknrvigsgcnldsarfrylmgerlgvhp
lschgwvlgehgdssvpvwsgvnvagvslkslnpqlgtdadkeqwkdvhkqvvdsayevi
klkgytswaiglsvadlaesimknlrrvhpistmikglygikedvflsvpcilgqngisd
vvkvtltpdeearlkksadtlwgiqkelqf