3EHJ
Crystal structure of DesKC-H188V in complex with AMP-PCP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-11-16 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.300, 34.300, 131.200 |
Unit cell angles | 90.00, 96.60, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.500 |
R-factor | 0.2 |
Rwork | 0.198 |
R-free | 0.24200 |
Structure solution method | SAD |
RMSD bond length | 0.023 |
RMSD bond angle | 2.030 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHARP |
Refinement software | REFMAC (5.5.0053) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.800 | 2.600 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.057 | 0.251 |
Number of reflections | 19539 | |
<I/σ(I)> | 9.86 | 3.1 |
Completeness [%] | 96.3 | 96.8 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 291 | PEG3350, CaCl2, bicine, ADP, pH 9, VAPOR DIFFUSION, HANGING DROP, temperature 291K |