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Structure paper

TitleBridging the gaps in design methodologies by evolutionary optimization of the stability and proficiency of designed Kemp eliminase KE59.
Journal, issue, pagesProc. Natl. Acad. Sci. USA, Vol. 109, Page 10358-10363, Year 2012
Publish dateDec 5, 2011 (structure data deposition date)
AuthorsKhersonsky, O. / Kiss, G. / Rothlisberger, D. / Dym, O. / Albeck, S. / Houk, K.N. / Baker, D. / Tawfik, D.S.
External linksProc. Natl. Acad. Sci. USA / PubMed:22685214
MethodsX-ray diffraction
Resolution1.45 - 2.5 Å
Structure data

PDB-3uxa:
Designed protein KE59 R1 7/10H
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-3uxd:
Designed protein KE59 R1 7/10H with dichlorobenzotriazole (DBT)
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-3uy7:
Designed protein KE59 R1 7/10H with G130S mutation
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-3uy8:
Designed protein KE59 R5_11/5F
Method: X-RAY DIFFRACTION / Resolution: 2.41 Å

PDB-3uyc:
Designed protein KE59 R8_2/7A
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-3uz5:
Designed protein KE59 R13 3/11H
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-3uzj:
Designed protein KE59 R13 3/11H with benzotriazole
Method: X-RAY DIFFRACTION / Resolution: 1.69 Å

Chemicals

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

ChemComp-0CU:
5,7-dichloro-1H-benzotriazole

ChemComp-SO4:
SULFATE ION

ChemComp-NA:
Unknown entry

ChemComp-0CT:
1H-benzotriazole

Source
  • escherichia coli (E. coli)
KeywordsLYASE / Structural Genomics / Israel Structural Proteomics Center / ISPC / Beta Barrel / LYASE/LYASE INHIBITOR / LYASE-LYASE INHIBITOR complex

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