5UW5
PCY1 H695A Variant in Complex with Follower Peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-02-02 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97857 |
| Spacegroup name | P 1 |
| Unit cell lengths | 65.020, 85.614, 137.870 |
| Unit cell angles | 87.49, 78.51, 89.44 |
Refinement procedure
| Resolution | 44.900 - 2.940 |
| R-factor | 0.18843 |
| Rwork | 0.186 |
| R-free | 0.22742 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.407 |
| Data reduction software | XDS |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.900 | 2.950 |
| High resolution limit [Å] | 2.940 | 2.940 |
| Number of reflections | 61150 | 637 |
| <I/σ(I)> | 11 | 2.8 |
| Completeness [%] | 98.8 | 98.9 |
| Redundancy | 3.9 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 282 | 16 % PEG 8,000, 50 mM calcium acetate, 0.1 M sodium cacodylate, 8 mg/mL protein, Protein was preincubated with 1 mM presegetalin A1 [14-32] |
