9GCD
CRYSTAL STRUCTURE OF HUMAN CHYMASE IN COMPLEX WITH Fulacimstat (COMPOUND86)
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-11-30 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.541870 |
| Spacegroup name | P 43 |
| Unit cell lengths | 74.080, 74.080, 49.790 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.718 - 1.798 |
| Rwork | 0.178 |
| R-free | 0.21200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.603 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.320 | 1.890 |
| High resolution limit [Å] | 1.790 | 1.790 |
| Rmerge | 0.051 | 0.318 |
| Number of reflections | 24967 | 3377 |
| <I/σ(I)> | 14.3 | 3 |
| Completeness [%] | 98.2 | |
| Redundancy | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 0.01M ZnCl2, 0.1M TRIS at pH 8 and 20% PEG 6000 |
