7VM4
Crystal structure of uPA in complex with nafamostat
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 | 2018-04-11 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | H 3 |
Unit cell lengths | 120.122, 120.122, 42.756 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.700 - 2.010 |
R-factor | 0.178 |
Rwork | 0.175 |
R-free | 0.22400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4dva |
RMSD bond length | 0.009 |
RMSD bond angle | 1.616 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.190 | 0.435 |
Number of reflections | 15377 | 1542 |
<I/σ(I)> | 13.1 | |
Completeness [%] | 99.9 | |
Redundancy | 10.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 2.0 M ammonium sulfate, 5% PEG400, 20 mM sodium citrate, pH 4.6 |