2GVJ
Crystal Structure of Human NMPRTase in complex with FK866
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-07-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97916 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 60.780, 105.896, 83.427 |
Unit cell angles | 90.00, 96.45, 90.00 |
Refinement procedure
Resolution | 82.760 - 2.100 |
R-factor | 0.25005 |
Rwork | 0.247 |
R-free | 0.29831 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.204 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | COMO |
Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 82.760 | |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 57137 | |
Completeness [%] | 98.3 | 98.25 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9.2 | 295 | 26% PEG 3350, 200 mM NaCL, BaCl2 as Additive, pH 9.2, VAPOR DIFFUSION, SITTING DROP, temperature 295K |