2K2Q

complex structure of the external thioesterase of the Surfactin-synthetase with a carrier domain

Summary for 2K2Q

Related2ron 2GDX
DescriptorTyrocidine synthetase 3 (Tyrocidine synthetase III), Surfactin synthetase thioesterase subunit (2 entities in total)
Functional Keywordsthioesterase, a/b-hydrolase, nrps, non-ribosomal peptide synthetase, type ii thioesterase, antibiotic biosynthesis, ligase, multifunctional enzyme, phosphopantetheine, sporulation, stress response, ligase-hydrolase complex, ligase/hydrolase
Biological sourceBrevibacillus parabrevis
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Cellular locationCytoplasm Q08788
Total number of polymer chains2
Total molecular weight36557.85
Authors
Koglin, A.,Lohr, F.,Bernhard, F.,Rogov, V.V.,Frueh, D.P.,Strieter, E.R.,Mofid, M.R.,Guntert, P.,Wagner, G.,Walsh, C.T.,Marahiel, M.A.,Dotsch, V. (deposition date: 2008-04-10, release date: 2008-12-09, Last modification date: 2018-01-24)
Primary citation
Koglin, A.,Lohr, F.,Bernhard, F.,Rogov, V.V.,Frueh, D.P.,Strieter, E.R.,Mofid, M.R.,Guntert, P.,Wagner, G.,Walsh, C.T.,Marahiel, M.A.,Dotsch, V.
Structural basis for the selectivity of the external thioesterase of the surfactin synthetase.
Nature, 454:907-911, 2008
PubMed: 18704089 (PDB entries with the same primary citation)
DOI: 10.1038/nature07161
MImport into Mendeley
Experimental method
SOLUTION NMR
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Structure validation

ClashscoreRamachandran outliersSidechain outliers64.3%14.8%MetricValuePercentile RanksWorseBetterPercentile relative to all structuresPercentile relative to all NMR structures