3ILF
Crystal structure of porphyranase A (PorA) in complex with neo-porphyrotetraose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-24 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.090, 68.378, 71.268 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.340 - 1.800 |
R-factor | 0.15965 |
Rwork | 0.157 |
R-free | 0.20461 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.026 |
RMSD bond angle | 2.302 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.340 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.062 | 0.212 |
Number of reflections | 27062 | |
<I/σ(I)> | 20.8 | 8.4 |
Completeness [%] | 94.6 | 91.4 |
Redundancy | 6.7 | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 295 | PEG 4000, Ammoniumsulfate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 295K |