3D9T
CIAP1-BIR3 in complex with N-terminal peptide from Caspase-9 (ATPFQE)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-01-01 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 30.268, 68.427, 122.358 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.040 - 1.500 |
R-factor | 0.186 |
Rwork | 0.183 |
R-free | 0.20500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1nw9 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | CNX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 61.200 | 1.550 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.052 | 0.257 |
Number of reflections | 40966 | |
<I/σ(I)> | 35.4 | 5.5 |
Completeness [%] | 98.0 | 98.6 |
Redundancy | 6.4 | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 3.1M NA FORMATE,10% GLYCEROL,1.5MM PEPTIDE, VAPOR DIFFUSION, HANGING DROP, temperature 293K |