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TitleCrystal and NMR structures of a Trp-cage mini-protein benchmark for computational fold prediction.
Journal, issue, pagesProc. Natl. Acad. Sci. USA, Vol. 109, Page 12521-12525, Year 2012
Publish dateOct 26, 2011 (structure data deposition date)
AuthorsScian, M. / Lin, J.C. / Le Trong, I. / Makhatadze, G.I. / Stenkamp, R.E. / Andersen, N.H.
External linksProc. Natl. Acad. Sci. USA / PubMed:22802678
MethodsNMR (solution) / X-ray diffraction
Resolution1.1 - 1.33 Å
Structure data

PDB-2ll5:
Cyclo-TC1 Trp-cage
Method: SOLUTION NMR

PDB-3uc7:
Trp-cage cyclo-TC1 - monoclinic crystal form
Method: X-RAY DIFFRACTION / Resolution: 1.1 Å

PDB-3uc8:
Trp-cage cyclo-TC1 - tetragonal crystal form
Method: X-RAY DIFFRACTION / Resolution: 1.33 Å

Chemicals

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-TRS:
2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / pH buffer*YM

KeywordsDE NOVO PROTEIN / TRP-CAGE / miniprotein / cyclic peptide / UNKNOWN FUNCTION / mini-protein / multimer / protein-protein interaction

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