PDB entry 4g5f
View 4g5f on RCSB PDB site
Description: Pantothenate synthetase in complex with racemate (2S)-2,3-DIHYDRO-1,4-BENZODIOXINE-2-CARBOXYLIC ACID and (2R)-2,3-DIHYDRO-1,4-BENZODIOXINE-2-CARBOXYLIC ACID
Class: Ligase/Ligase inhibitor
Keywords: Alpha Beta 3-Layer(aba) Sandwich Rossmann fold, Ligase, ATP binding Pantoate binding beta-Alanine binding, Ligase-Ligase inhibitor complex
Deposited on
2012-07-17, released
2013-07-17
The last revision prior to the SCOPe 2.07 freeze date was dated
2013-09-04, with a file datestamp of
2013-08-30.
Experiment type: XRAY
Resolution: 2.33 Å
R-factor: 0.174
AEROSPACI score: 0.38
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: Pantothenate synthetase
Species: Mycobacterium tuberculosis [TaxId:1773]
Gene: MT3707, MTCY07H7B.20, panC, Rv3602c
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.07: d4g5fa_ - Chain 'B':
Compound: Pantothenate synthetase
Species: Mycobacterium tuberculosis [TaxId:1773]
Gene: MT3707, MTCY07H7B.20, panC, Rv3602c
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.07: d4g5fb_ - Heterogens: GOL, 0JD, 15N, EDO, EOH, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence, based on SEQRES records: (download)
>4g5fA (A:)
maipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpgs
vvvvsifvnpmqfgaggdldayprtpdddlaqlraegveiaftpttaamypdglrttvqp
gplaaeleggprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldva
vvgvptvreadglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravld
aapgvavdylelrdiglgpmplngsgrllvaarlgttrlldniaieigtfagtdrpdgyr
aileshwrn
Sequence, based on observed residues (ATOM records): (download)
>4g5fA (A:)
pafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpgsvvv
vsifvnpmqfdldayprtpdddlaqlraegveiaftpttaamypdglrttvqpgplaael
eggprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldvavvgvptv
readglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravldaapgvav
dylelrdiglgpmplngsgrllvaarlgttrlldniaieigt
- Chain 'B':
Sequence, based on SEQRES records: (download)
>4g5fB (B:)
maipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpgs
vvvvsifvnpmqfgaggdldayprtpdddlaqlraegveiaftpttaamypdglrttvqp
gplaaeleggprpthfagvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldva
vvgvptvreadglamssrnryldpaqraaavalsaaltaaahaatagaqaaldaaravld
aapgvavdylelrdiglgpmplngsgrllvaarlgttrlldniaieigtfagtdrpdgyr
aileshwrn
Sequence, based on observed residues (ATOM records): (download)
>4g5fB (B:)
aipafhpgelnvysapgdvadvsralrltgrrvmlvptmgalheghlalvraakrvpgsv
vvvsifvnppdddlaqlraegveiaftpttaamypdglrttvqpgplaaeleggprpthf
agvltvvlkllqivrpdrvffgekdyqqlvlirqlvadfnldvavvgvptvreadglams
srnryldpaqraaavalsaaltaaahaatagaqaaldaaravldaapgvavdylelrdig
lgpmplngsgrllvaarlgttrlldniaieig