PDB entry 3coy

View 3coy on RCSB PDB site
Description: Crystal Structure of Mycobacterium Tuberculosis Pantothenate Synthetase at 2.05 Ang resolution- in complex with sulphonamide inhibitor 3
Class: ligase
Keywords: Mycobacterium tuberculosis, pantothenate biosynthesis, enzymes, ligase, inhibitors, drug design, ATP-binding, Magnesium, Metal-binding, Nucleotide-binding
Deposited on 2008-03-29, released 2008-10-07
The last revision prior to the SCOPe 2.07 freeze date was dated 2011-07-13, with a file datestamp of 2011-05-25.
Experiment type: XRAY
Resolution: 2.03 Å
R-factor: 0.169
AEROSPACI score: 0.46 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Pantothenate synthetase
    Species: Mycobacterium tuberculosis
    Gene: panC
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d3coya_
  • Chain 'B':
    Compound: Pantothenate synthetase
    Species: Mycobacterium tuberculosis
    Gene: panC
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A5R0
      • engineered (2)
    Domains in SCOPe 2.07: d3coyb_
  • Heterogens: 53H, GOL, EOH, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3coyA (A:)
amaipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpg
svvvvsifvnpmqfgaggdldayprtpdddlaqlraegveiaftpttaamypdglrttvq
pgplaaeleggprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldv
avvgvptvreadglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravl
daapgvavdylelrdiglgpmplngsgrllvaarlgttrlldniaieigtfagtdrpdgy
r

    Sequence, based on observed residues (ATOM records): (download) 
    >3coyA (A:)
ipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpgsvv
vvsifvnpmqfgayprtpdddlaqlraegveiaftpttaamypdglrttvqpgplaaele
ggprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldvavvgvptvr
eadglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravldaapgvavd
ylelrdiglgpmngsgrllvaarlgttrlldniaieigtf

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3coyB (B:)
amaipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpg
svvvvsifvnpmqfgaggdldayprtpdddlaqlraegveiaftpttaamypdglrttvq
pgplaaeleggprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldv
avvgvptvreadglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravl
daapgvavdylelrdiglgpmplngsgrllvaarlgttrlldniaieigtfagtdrpdgy
r

    Sequence, based on observed residues (ATOM records): (download) 
    >3coyB (B:)
aipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpgsv
vvvsifvnpmqayprtpdddlaqlraegveiaftpttaamypdglrttvqpgplaaeleg
gprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldvavvgvptvre
adglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravldaapgvavdy
lelrdiglgpmplngsgrllvaarlgttrlldniaieig