4ZHM
The crystal structure of mupain-1--16-IG in complex with murinised human uPA at pH7.4
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.979 |
Spacegroup name | H 3 |
Unit cell lengths | 120.897, 120.897, 42.311 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.920 - 1.900 |
R-factor | 0.22554 |
Rwork | 0.223 |
R-free | 0.26415 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.212 |
Data scaling software | HKL-2000 |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 1.900 |
Number of reflections | 17980 |
<I/σ(I)> | 31.3 |
Completeness [%] | 98.5 |
Redundancy | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 298 | 2.0M ammonium sulfate, 50mM sodium citrate, pH 4.6, 5% polyethylene glycol (PEG) 400 |