7N3R
The ternary complex of human Bisphosphoglycerate mutase with 3-phosphoglycerate and 2-phosphoglycolate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-03-17 |
Detector | DECTRIS EIGER R 4M |
Wavelength(s) | 1.54056 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 53.072, 70.865, 159.803 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.648 - 2.250 |
R-factor | 0.206 |
Rwork | 0.203 |
R-free | 0.27360 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2h4z |
Data reduction software | CrysalisPro (41_64_69a) |
Data scaling software | Aimless (0.5.32) |
Phasing software | PHASER (2.8.1) |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.650 | 2.330 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.084 | 0.491 |
Rmeas | 0.090 | 0.524 |
Rpim | 0.031 | 0.181 |
Number of reflections | 29181 | 2677 |
<I/σ(I)> | 15 | 4.2 |
Completeness [%] | 99.2 | 100 |
Redundancy | 7.9 | 8 |
CC(1/2) | 0.999 | 0.916 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 293 | 0.1 M BIS TRIS propane, 18% polyethylene glycol 8000, 10% v/v polyethylene glycol 200 |