4LWB

Structure of Bacillus subtilis nitric oxide synthase in complex with 6-((((3R,5S)-5-(((6-amino-4-methylpyridin-2-yl)methoxy)methyl)pyrrolidin-3-yl)oxy)methyl)-4-methylpyridin-2-amine

Summary for 4LWB

Related4LUW 4LUX 4LWA
DescriptorNitric oxide synthase oxygenase, PROTOPORPHYRIN IX CONTAINING FE, 6-({[(3R,5S)-5-{[(6-amino-4-methylpyridin-2-yl)methoxy]methyl}pyrrolidin-3-yl]oxy}methyl)-4-methylpyridin-2-amine, ... (7 entities in total)
Functional Keywordsnitric oxide synthase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
Biological sourceBacillus subtilis subsp. subtilis
Total number of polymer chains1
Total molecular weight43314
Authors
Holden, J.K.,Li, H.,Poulos, T.L. (deposition date: 2013-07-26, release date: 2013-10-23, Last modification date: 2017-11-15)
Primary citation
Holden, J.K.,Li, H.,Jing, Q.,Kang, S.,Richo, J.,Silverman, R.B.,Poulos, T.L.
Structural and biological studies on bacterial nitric oxide synthase inhibitors.
Proc.Natl.Acad.Sci.USA, 110:18127-18131, 2013
PubMed: 24145412 (PDB entries with the same primary citation)
DOI: 10.1073/pnas.1314080110
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.15 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.242402.6%2.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 4lwb
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Molmil generated image of 4lwb
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More Biological unit images

Molmil generated image of 4lwb
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Molmil generated image of 4lwb
rotated about x axis by 90°
Molmil generated image of 4lwb
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 (4lwb.pdb1.gz [128.81 KB])
Coordinate files for Biological unit (4lwb.pdb2.gz [255.25 KB])