2W3U
formate complex of the Ni-Form of E.coli deformylase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2007-06-24 |
Detector | RIGAKU CCD |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 54.590, 54.590, 228.610 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.300 - 1.960 |
R-factor | 0.24992 |
Rwork | 0.247 |
R-free | 0.28542 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xeo |
RMSD bond length | 0.013 |
RMSD bond angle | 1.452 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0047) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.030 |
High resolution limit [Å] | 1.960 | 1.960 |
Rmerge | 0.100 | 0.370 |
Number of reflections | 14750 | |
<I/σ(I)> | 11.5 | 1.3 |
Completeness [%] | 95.5 | 64.5 |
Redundancy | 6.37 | 1.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.1 | 293 | 20% PEG4000, 0.2M (NH4)2SO4, 0.1M NAOAC PH 4.1, 293 K |