Ki Summary

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Target

Salicyl-AMP ligase / salicyl-S-ArCP synthetase

Ligand

BDBM50244934

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_511444 (CHEMBL1003925)

0.27±n/a nM

Citation

Neres, J; Labello, NP; Somu, RV; Boshoff, HI; Wilson, DJ; Vannada, J; Chen, L; Barry, CE; Bennett, EM; Aldrich, CC Inhibition of siderophore biosynthesis in Mycobacterium tuberculosis with nucleoside bisubstrate analogues: structure-activity relationships of the nucleobase domain of 5'-O-[N-(salicyl)sulfamoyl]adenosine. J Med Chem51:5349-70 (2008) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Salicyl-AMP ligase / salicyl-S-ArCP synthetase

Name:

Salicyl-AMP ligase / salicyl-S-ArCP synthetase

Synonyms:

2,3-dihydroxybenzoate-AMP ligase | MBTA_MYCTU | mbtA

Type:

PROTEIN

Mol. Mass.:

59275.32

Organism:

Mycobacterium tuberculosis

Description:

ChEMBL_423930

Residue:

565

Sequence:

MPPKAADGRRPSPDGGLGGFVPFPADRAASYRAAGYWSGRTLDTVLSDAARRWPDRLAVA
DAGDRPGHGGLSYAELDQRADRAAAALHGLGITPGDRVLLQLPNGCQFAVALFALLRAGA
IPVMCLPGHRAAELGHFAAVSAATGLVVADVASGFDYRPMARELVADHPTLRHVIVDGDP
GPFVSWAQLCAQAGTGSPAPPADPGSPALLLVSGGTTGMPKLIPRTHDDYVFNATASAAL
CRLSADDVYLVVLAAGHNFPLACPGLLGAMTVGATAVFAPDPSPEAAFAAIERHGVTVTA
LVPALAKLWAQSCEWEPVTPKSLRLLQVGGSKLEPEDARRVRTALTPGLQQVFGMAEGLL
NFTRIGDPPEVVEHTQGRPLCPADELRIVNADGEPVGPGEEGELLVRGPYTLNGYFAAER
DNERCFDPDGFYRSGDLVRRRDDGNLVVTGRVKDVICRAGETIAASDLEEQLLSHPAIFS
AAAVGLPDQYLGEKICAAVVFAGAPITLAELNGYLDRRGVAAHTRPDQLVAMPALPTTPI
GKIDKRAIVRQLGIATGPVTTQRCH

BDBM50244934

n/a

Name

BDBM50244934

Synonyms:

5'-O-[N-(2-Hydroxybenzoyl)sulfamoyl]-2-phenyladenosine TriethylammoniumSalt

Type

Small organic molecule

Emp. Form.

C23H21N6O8S

Mol. Mass.

541.514

SMILES

Nc1nc(nc2n(cnc12)[C@@H]1O[C@H](COS(=O)(=O)[N-]C(=O)c2ccccc2O)[C@@H](O)[C@H]1O)-c1ccccc1 |r|

Structure