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5YIB

Crystal Structure of KNI-10743 bound Plasmepsin II (PMII) from Plasmodium falciparum

Summary for 5YIB
Entry DOI10.2210/pdb5yib/pdb
DescriptorPlasmepsin II, (4R)-3-[(2S,3S)-3-[2-[4-[2-(dimethylamino)ethyl-methyl-amino]-2,6-dimethyl-phenoxy]ethanoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]-1,3-thiazolidine-4-carboxamide, GLYCEROL, ... (6 entities in total)
Functional Keywordsplasmepsin, plasmepsin ii, kni-10743, aspartic protease, plasmodium falciparum, drug development, inhibitor, hydrolase
Biological sourcePlasmodium falciparum (isolate 3D7)
Total number of polymer chains1
Total formula weight38788.07
Authors
Rathore, I.,Mishra, V.,Bhaumik, P. (deposition date: 2017-10-03, release date: 2018-07-11, Last modification date: 2019-05-29)
Primary citationMishra, V.,Rathore, I.,Arekar, A.,Sthanam, L.K.,Xiao, H.,Kiso, Y.,Sen, S.,Patankar, S.,Gustchina, A.,Hidaka, K.,Wlodawer, A.,Yada, R.Y.,Bhaumik, P.
Deciphering the mechanism of potent peptidomimetic inhibitors targeting plasmepsins - biochemical and structural insights.
Febs J., 285:3077-3096, 2018
Cited by
PubMed: 29943906
DOI: 10.1111/febs.14598
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.15 Å)
Structure validation

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