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Structure paper

TitleOptimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution
Journal, issue, pagesJ. Mol. Biol., Vol. 407, Page 391-412, Year 2011
Publish dateJun 29, 2010 (structure data deposition date)
AuthorsKhersonsky, O. / Rothlisberger, D. / Wollacott, A.M. / Murphy, P. / Dym, O. / Albeck, S. / Kiss, G. / Houk, K.N. / Baker, D. / Tawfik, D.S.
External linksJ. Mol. Biol. / PubMed:21277311
MethodsX-ray diffraction
Resolution1.4 - 2.25 Å
Structure data

PDB-3npu:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

PDB-3npv:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution
Method: X-RAY DIFFRACTION / Resolution: 1.48 Å

PDB-3npw:
In silico designed of an improved Kemp eliminase KE70 mutant by computational design and directed evolution
Method: X-RAY DIFFRACTION / Resolution: 2.14 Å

PDB-3npx:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution
Method: X-RAY DIFFRACTION / Resolution: 1.79 Å

PDB-3nq2:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R2 3/5G
Method: X-RAY DIFFRACTION / Resolution: 2.02 Å

PDB-3nq8:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R4 8/5A
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-3nqv:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R5 7/4A
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

PDB-3nr0:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution R6 6/10A
Method: X-RAY DIFFRACTION / Resolution: 2.19 Å

PDB-3q2d:
Optimization of the in silico designed Kemp eliminase KE70 by computational design and directed evolution
Method: X-RAY DIFFRACTION / Resolution: 2.19 Å

Chemicals

ChemComp-HOH:
WATER

ChemComp-IMD:
IMIDAZOLE

ChemComp-NO3:
NITRATE ION

ChemComp-BEN:
BENZAMIDINE

ChemComp-3NY:
5-nitro-1H-benzotriazole

Source
  • escherichia coli (E. coli)
KeywordsLYASE / TIM / Structural Genomics / Israel Structural Proteomics Center / ISPC

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