9MD8

Hip1 complex with inhibitor #2 (Hip1-2) via Ser228

This is a non-PDB format compatible entry.

Summary for 9MD8

• Entry DOI: 10.2210/pdb9md8/pdb
• Descriptor: Protease, N-carboxy-L-phenylalanyl-N-{(2S,3R)-3-hydroxy-4-methoxy-4-oxo-1-[(3R)-2-oxo-3,4-dihydro-2H-pyrrol-3-yl]butan-2-yl}-L-lysinamide, GLYCEROL, ... (4 entities in total)
• Functional Keywords: tuberculosis, protease inhibitor, rv2224c/caea/hip1, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Mycobacterium tuberculosis
• Total number of polymer chains: 1
• Total formula weight: 52843.02

Authors

Yim, M.K.,Schumann, N.C.,Goldfarb, N.E.,Johnson, S.J. (deposition date: 2024-12-05, release date: 2025-12-17)

• Primary citation: Schumann, N.C.,Harris, H.T.,Rouse Salcido, E.M.,Brooks, C.L.,Pena, K.J.,Karakousis, P.C.,Abell, A.D.,Olsen, K.J.,Yim, M.K.,Johnson, S.J.,Goldfarb, N.E.; Discovery of Highly Potent alpha-Keto Ester-Based Peptidomimetic Inhibitors of the Hip1 Protease for the Treatment of Mycobacterium tuberculosis; To Be Published,

Experimental method

X-RAY DIFFRACTION (2.3 Å)