2VE1

Isopenicillin N synthase with substrate analogue AsMCOV (oxygen exposed 1min 20bar)

Summary for 2VE1

Related1HB4 1BLZ 2VBD 2VCM 1OC1 1ODN 2VAU 1W3V 1QJE 1HB2 1W03 2VBB 1W06 1UZW 1IPS 1HB1 2IVJ 1BK0 1W3X 2JB4 1W05 2VBP 1W04 1HB3 1QIQ 1QJF 1OBN 2BU9 2IVI 2BJS 1ODM
DescriptorISOPENICILLIN N SYNTHETASE, FE (II) ION, N~6~-[(1R)-1-({[(1R,2R)-1-CARBOXY-3-HYDROXY-2-METHYLPROPYL]OXY}CARBONYL)-2-MERCAPTOPROP-2-EN-1-YL]-6-OXO-L-LYSINE, ... (5 entities in total)
Functional Keywordsantibiotic biosynthesis, penicillin biosynthesis, iron, oxygenase, vitamin c, metal-binding, monocyclic intermediate, oxidoreductase, b-lactam antibiotic
Biological sourceEMERICELLA NIDULANS
Total number of polymer chains1
Total molecular weight38390.55
Authors
Ge, W.,Clifton, I.J.,Adlington, R.M.,Baldwin, J.E.,Rutledge, P.J. (deposition date: 2007-10-15, release date: 2008-11-04, Last modification date: 2017-06-14)
Primary citation
Ge, W.,Clifton, I.J.,Howard-Jones, A.R.,Stok, J.E.,Adlington, R.M.,Baldwin, J.E.,Rutledge, P.J.
Structural Studies on the Reaction of Isopenicillin N Synthase with a Sterically Demanding Depsipeptide Substrate Analogue.
Chembiochem, 10:2025-, 2009
PubMed: 19598184 (PDB entries with the same primary citation)
DOI: 10.1002/CBIC.200900080
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.2 Å)
?

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.248803.2%1.5%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 2ve1
no rotation
Molmil generated image of 2ve1
rotated about x axis by 90°
Molmil generated image of 2ve1
rotated about y axis by 90°