3RAS
Crystal structure of 1-deoxy-D-xylulose 5-phosphate reductoisomerase (DXR) complexed with a lipophilic phosphonate inhibitor
Summary for 3RAS
Entry DOI | 10.2210/pdb3ras/pdb |
Related | 2JCV 2JCZ |
Descriptor | 1-deoxy-D-xylulose 5-phosphate reductoisomerase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 3-(N-HYDROXYACETAMIDO)-1-(3,4-DICHLOROPHENYL)PROPYLPHOSPHONIC ACID, ... (7 entities in total) |
Functional Keywords | oxidoreductase, doxp/mep pathway, isoprene biosynthesis, 1-deoxy-d-xylulose 5-phosphate reductoisomerase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor |
Biological source | Mycobacterium tuberculosis |
Total number of polymer chains | 2 |
Total formula weight | 86467.18 |
Authors | Diao, J.,Deng, L.,Prasad, B.V.V.,Song, Y. (deposition date: 2011-03-28, release date: 2011-05-25, Last modification date: 2024-02-21) |
Primary citation | Deng, L.,Diao, J.,Chen, P.,Pujari, V.,Yao, Y.,Cheng, G.,Crick, D.C.,Prasad, B.V.,Song, Y. Inhibition of 1-deoxy-D-xylulose-5-phosphate reductoisomerase by lipophilic phosphonates: SAR, QSAR, and crystallographic studies. J.Med.Chem., 54:4721-4734, 2011 Cited by PubMed: 21561155DOI: 10.1021/jm200363d PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.55 Å) |
Structure validation
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