PDB entry 6thc
View 6thc on RCSB PDB site
Description: Crystal structure of Mycobacterium smegmatis CoaB in complex with CTP and (4-hydroxyphenyl)(2,3,4-trihydroxyphenyl)methanone
Class: ligase
Keywords: CoaBC, bifunctional Phosphopantothenoylcysteine decarboxylase/phosphopantothenate-cysteine ligase, phosphopantothenate-cysteine ligase, Phosphopantothenoylcysteine decarboxylase, phosphopantothenoylcysteine synthetase, LIGASE
Deposited on
2019-11-19, released
2020-11-25
The last revision prior to the SCOPe 2.08 freeze date was dated
2021-01-20, with a file datestamp of
2021-01-15.
Experiment type: XRAY
Resolution: 2.03 Å
R-factor: N/A
AEROSPACI score: 0.37
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: Coenzyme A biosynthesis bifunctional protein coaBC
Species: Mycolicibacterium smegmatis [TaxId:1772]
Gene: coaBC, MSMEG_3054
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.08: d6thca1, d6thca2 - Chain 'B':
Compound: Coenzyme A biosynthesis bifunctional protein coaBC
Species: Mycolicibacterium smegmatis [TaxId:1772]
Gene: coaBC, MSMEG_3054
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.08: d6thcb1, d6thcb2 - Chain 'C':
Compound: Coenzyme A biosynthesis bifunctional protein coaBC
Species: Mycolicibacterium smegmatis [TaxId:1772]
Gene: coaBC, MSMEG_3054
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.08: d6thcc1, d6thcc2 - Chain 'D':
Compound: Coenzyme A biosynthesis bifunctional protein coaBC
Species: Mycolicibacterium smegmatis [TaxId:1772]
Gene: coaBC, MSMEG_3054
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.08: d6thcd1, d6thcd2 - Heterogens: N9N, CTP, CA, ACT, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence, based on SEQRES records: (download)
>6thcA (A:)
mahhhhhhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliag
ntaglidpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkgas
epssidlvrnddvlagavraradgqlpnmraivgfaaetgdangdvlfharaklerkgcd
llvvnavgenrafevdhndgwllsadgtesalehgsktlmatrivdsiaaflksqdg
Sequence, based on observed residues (ATOM records): (download)
>6thcA (A:)
hhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliagntagli
dpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkpssidlvrn
ddvlagavraradgqlpnmraivgfaaetgdangdvlfharaklerkgcdllvvnavdgw
llsadgtesalehgsktlmatrivdsiaaflksq
- Chain 'B':
Sequence, based on SEQRES records: (download)
>6thcB (B:)
mahhhhhhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliag
ntaglidpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkgas
epssidlvrnddvlagavraradgqlpnmraivgfaaetgdangdvlfharaklerkgcd
llvvnavgenrafevdhndgwllsadgtesalehgsktlmatrivdsiaaflksqdg
Sequence, based on observed residues (ATOM records): (download)
>6thcB (B:)
hhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliagntagli
dpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkgasepssid
lvrnddvlagavraradgqlpnmraivgfaaetvlfharaklerkgcdllvvnavgenra
fevdhndgwllsadgtesalehgsktlmatrivdsiaaflksq
- Chain 'C':
Sequence, based on SEQRES records: (download)
>6thcC (C:)
mahhhhhhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliag
ntaglidpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkgas
epssidlvrnddvlagavraradgqlpnmraivgfaaetgdangdvlfharaklerkgcd
llvvnavgenrafevdhndgwllsadgtesalehgsktlmatrivdsiaaflksqdg
Sequence, based on observed residues (ATOM records): (download)
>6thcC (C:)
hhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliagntagli
dpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikssidlvrndd
vlagavraradgqlpnmraivgfaaetgdangdvlfharaklerkgcdllvvnavndgwl
lsadgtesalehgsktlmatrivdsiaaflksq
- Chain 'D':
Sequence, based on SEQRES records: (download)
>6thcD (D:)
mahhhhhhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliag
ntaglidpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkgas
epssidlvrnddvlagavraradgqlpnmraivgfaaetgdangdvlfharaklerkgcd
llvvnavgenrafevdhndgwllsadgtesalehgsktlmatrivdsiaaflksqdg
Sequence, based on observed residues (ATOM records): (download)
>6thcD (D:)
hhdmagvkalvtaggtrepldpvrfignrssgkqgyavarvlaqrgadvtliagntagli
dpagvemvhigsatqlrdavskhapdanvlvmaaavadfrpahvaaakikkgasepssid
lvrnddvlagavraradgqlpnmraivgfaaetggdvlfharaklerkgcdllvvnavge
nrafevddgwllsadgtesalehgsktlmatrivdsiaaflksq