3CCD
1.0 A Structure of Post-Succinimide His15Asp HPr
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-BM-C |
Synchrotron site | APS |
Beamline | 14-BM-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-02-26 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | .9984 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 33.658, 42.299, 48.297 |
Unit cell angles | 90.00, 89.95, 90.00 |
Refinement procedure
Resolution | 26.330 - 1.000 |
R-factor | 0.19152 |
Rwork | 0.191 |
R-free | 0.20502 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1opd |
RMSD bond length | 0.006 |
RMSD bond angle | 1.193 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.300 | 1.060 |
High resolution limit [Å] | 1.000 | 1.000 |
Number of reflections | 73053 | |
<I/σ(I)> | 16 | 4 |
Completeness [%] | 71.0 | 23 |
Redundancy | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.4 | 287 | 0.1M citrate phosphate buffer, 25% saturated ammonium sulphate, pH 4.4, VAPOR DIFFUSION, HANGING DROP, temperature 287K |