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Target
Ribonucleoside-diphosphate reductase subunit alpha
Ligand
BDBM50431417
Substrate
n/a
Meas. Tech.
ChEMBL_952415 (CHEMBL2352781)
Kd
8100±n/a nM
Citation
 Nurbo, J; Ericsson, DJ; Rosenström, U; Muthas, D; Jansson, AM; Lindeberg, G; Unge, T; Karlén, A Novel pseudopeptides incorporating a benzodiazepine-based turn mimetic--targeting Mycobacterium tuberculosis ribonucleotide reductase. Bioorg Med Chem 21:1992-2000 (2013) [PubMed]  Article
Target
Name:
Ribonucleoside-diphosphate reductase subunit alpha
Synonyms:
MT3137 | RIR1_MYCTU | Ribonucleotide reductase R1 subunit | nrdE
Type:
PROTEIN
Mol. Mass.:
82438.64
Organism:
Mycobacterium tuberculosis
Description:
ChEMBL_952415
Residue:
725
Sequence:
MPPTVIAEPVASGAHASYSGGPGETDYHALNAMLNLYDADGKIQFDKDREAAHQYFLQHVNQNTVFFHNQDEKLDYLIRENYYEREVLDQYSRNFVKTLLDRAYAKKFRFPTFLGAFKYYTSYTLKTFDGKRYLERFEDRVVMVALTLAAGDTALAELLVDEIIDGRFQPATPTFLNSGKKQRGEPVSCFLLRVEDNMESIGRSINSALQLSKRGGGVALLLTNIREHGAPIKNIENQSSGVIPIMKLLEDAFSYANQLGARQGAGAVYLHAHHPDIYRFLDTKRENADEKIRIKTLSLGVVIPDITFELAKRNDDMYLFSPYDVERVYGVPFADISVTEKYYEMVDDARIRKTKIKAREFFQTLAELQFESGYPYIMFEDTVNRANPIDGKITHSNLCSEILQVSTPSLFNEDLSYAKVGKDISCNLGSLNIAKTMDSPDFAQTIEVAIRALTAVSDQTHIKSVPSIEQGNNDSHAIGLGQMNLHGYLARERIFYGSDEGIDFTNIYFYTVLYHALRASNRIAIERGTHFKGFERSKYASGEFFDKYTDQIWEPKTQKVRQLFADAGIRIPTQDDWRRLKESVQAHGIYNQNLQAVPPTGSISYINHSTSSIHPIVSKVEIRKEGKIGRVYYPAPYMTNDNLEYYEDAYEIGYEKIIDTYAAATQHVDQGLSLTLFFKDTATTRDVNKAQIYAWRKGIKTLYYIRLRQMALEGTEVEGCVSCML
  
Inhibitor
Name:
BDBM50431417
Synonyms:
CHEMBL2348059
Type:
Small organic molecule
Emp. Form.:
C35H30N4O5
Mol. Mass.:
586.6365
SMILES:
OC(=O)CN1Cc2cccc(NC(=O)OCC3c4ccccc4-c4ccccc34)c2N[C@@H](Cc2c[nH]c3ccccc23)C1=O |r|
Structure:
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