2I1W
Crystal structure of NAD kinase 1 from Listeria monocytogenes
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 100 |
Collection date | 2004-05-05 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.612, 119.017, 67.937 |
Unit cell angles | 90.00, 102.08, 90.00 |
Refinement procedure
Resolution | 34.370 - 2.340 |
R-factor | 0.19607 |
Rwork | 0.194 |
R-free | 0.25696 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1u0r |
RMSD bond length | 0.013 |
RMSD bond angle | 1.374 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 34.370 |
High resolution limit [Å] | 2.340 |
Rmerge | 0.066 |
Number of reflections | 42609 |
<I/σ(I)> | 13.9 |
Completeness [%] | 97.5 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 0.3 M potassium chloride, 50 mM tri-sodium citrate, 15-20% w/v polyethylene glycol 400, 10 mM KI, pH 5.4, VAPOR DIFFUSION, HANGING DROP, pH 5.40 |