1T4C
Formyl-CoA Transferase in complex with Oxalyl-CoA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I711 |
Synchrotron site | MAX II |
Beamline | I711 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2004-02-08 |
Detector | MARRESEARCH |
Wavelength(s) | 1.087 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 100.163, 100.163, 196.872 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.610 |
R-factor | 0.20369 |
Rwork | 0.200 |
R-free | 0.27308 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1p5r |
RMSD bond length | 0.021 |
RMSD bond angle | 1.821 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.480 | 2.670 |
High resolution limit [Å] | 2.610 | 2.600 |
Number of reflections | 30208 | |
<I/σ(I)> | 15.6 | 4.6 |
Completeness [%] | 99.1 | 100 |
Redundancy | 6.4 | 6.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | Mg acetate, PEG 8000, Na cacodylate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |