4UN1
Sirohaem decarboxylase AhbA/B - an enzyme with structural homology to the Lrp/AsnC transcription factor family that is part of the alternative haem biosynthesis pathway.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Collection date | 2014-04-08 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.300, 78.600, 150.300 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.230 - 1.970 |
R-factor | 0.2049 |
Rwork | 0.202 |
R-free | 0.25732 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4czd |
RMSD bond length | 0.018 |
RMSD bond angle | 2.235 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.000 | 2.020 |
High resolution limit [Å] | 1.970 | 1.970 |
Rmerge | 0.080 | 0.800 |
Number of reflections | 46648 | |
<I/σ(I)> | 13.38 | 2.5 |
Completeness [%] | 99.2 | 97 |
Redundancy | 5.3 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | 0.1M SODIUM ACETATE PH5, 0.2M AMMONIUM ACETATE, 30% PEG 4000, 0.01M BACL2, pH 5.0 |