2IGX

Achiral, Cheap and Potent Inhibitors of Plasmepsins II

Summary for 2IGX

Related2BJU 2IGY
DescriptorPlasmepsin-2, 5-PENTYL-N-{[4'-(PIPERIDIN-1-YLCARBONYL)BIPHENYL-4-YL]METHYL}-N-[1-(PYRIDIN-2-YLMETHYL)PIPERIDIN-4-YL]PYRIDINE-2-CARBOXAMIDE (3 entities in total)
Functional Keywordsachiral inhibitor, hydrolase
Biological sourcePlasmodium falciparum (malaria parasite P. falciparum)
Cellular locationVacuole P46925
Total number of polymer chains1
Total molecular weight37597.59
Authors
Prade, L. (deposition date: 2006-09-25, release date: 2006-11-28, Last modification date: 2017-10-18)
Primary citation
Boss, C.,Corminboeuf, O.,Grisostomi, C.,Meyer, S.,Jones, A.F.,Prade, L.,Binkert, C.,Fischli, W.,Weller, T.,Bur, D.
Achiral, Cheap, and Potent Inhibitors of Plasmepsins I, II, and IV.
Chemmedchem, 1:1341-1345, 2006
PubMed: 17091526 (PDB entries with the same primary citation)
DOI: 10.1002/cmdc.200600223
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.7 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.23480.3%3.1%9.1%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 2igx
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Molmil generated image of 2igx
rotated about x axis by 90°
Molmil generated image of 2igx
rotated about y axis by 90°

More Biological unit images

Molmil generated image of 2igx
no rotation
Molmil generated image of 2igx
rotated about x axis by 90°
Molmil generated image of 2igx
rotated about y axis by 90°
(*)In the case of coarse surface representation, the asymmetric unit is shown as red ribbon representation.
Coordinate files for Biological unit (2igx.pdb2.gz [124.15 KB])
Coordinate files for Biological unit (2igx.pdb1.gz [63.24 KB])