6BVH
Trypsin complexed with a modified sunflower trypsin inhibitor, SFTI-TCTR(N12,N14)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ELLIOTT GX-13 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2015-08-11 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 61.680, 63.240, 69.320 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.660 - 1.927 |
R-factor | 0.1334 |
Rwork | 0.132 |
R-free | 0.15820 |
Data reduction software | MOSFLM (7.2.0) |
Data scaling software | Aimless (0.5.12) |
Refinement software | PHENIX (1.13rc1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.240 | 1.970 |
High resolution limit [Å] | 1.927 | 1.930 |
Rmerge | 0.035 | 0.063 |
Rmeas | 0.041 | 0.075 |
Rpim | 0.021 | 0.040 |
Number of reflections | 20647 | 1331 |
<I/σ(I)> | 27.1 | |
Completeness [%] | 98.0 | 95.2 |
Redundancy | 3.6 | 3.5 |
CC(1/2) | 0.998 | 0.993 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | 50 mM MES, 50 mM benzamidine, 1mM CaCl2 |