3EZO
Crystal structure of acyl-carrier-protein s-malonyltransferase from burkholderia pseudomallei 1710b
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-09-19 |
Detector | RIGAKU SATURN 944 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 54.920, 117.470, 44.530 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.130 - 2.050 |
R-factor | 0.158 |
Rwork | 0.155 |
R-free | 0.20800 |
Structure solution method | MR, MR |
Starting model (for MR) | 1mla modified with ccp4 chainsaw |
RMSD bond length | 0.018 |
RMSD bond angle | 1.488 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0046) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.100 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.083 | 0.240 |
Number of reflections | 18128 | |
<I/σ(I)> | 19.24 | 7.6 |
Completeness [%] | 96.4 | 76.4 |
Redundancy | 6.9 | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 290 | JCSG+ SCREEN H3: 100MM BISTRIS PH 5.5, 25% PEG 3350, VAPOR DIFFUSION, TEMPERATURE 290K, pH 5.50, VAPOR DIFFUSION, SITTING DROP |