2H5Y
Crystallographic structure of the Molybdate-Binding Protein of Xanthomonas citri at 1.7 Ang resolution bound to molybdate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE D03B-MX1 |
Synchrotron site | LNLS |
Beamline | D03B-MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-01-13 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.421 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 68.153, 172.138, 112.036 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.070 - 1.700 |
R-factor | 0.16833 |
Rwork | 0.167 |
R-free | 0.20237 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1amf |
RMSD bond length | 0.012 |
RMSD bond angle | 1.752 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 72786 | |
<I/σ(I)> | 26.6 | 3.3 |
Completeness [%] | 99.8 | 99.3 |
Redundancy | 5.7 | 5.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 291 | 0.2M lithium sulfate, 0.1M Tris-HCl, 30% PEG 4000 , pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K |