3Q2G
Adamts1 in complex with a novel N-hydroxyformamide inhibitors
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E DW |
Temperature [K] | 100 |
Collection date | 2005-12-05 |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.309, 63.419, 114.912 |
Unit cell angles | 90.00, 89.88, 90.00 |
Refinement procedure
Resolution | 114.710 - 2.300 |
R-factor | 0.21071 |
Rwork | 0.208 |
R-free | 0.26068 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2jih |
RMSD bond length | 0.011 |
RMSD bond angle | 1.234 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 114.710 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Number of reflections | 31938 | |
Completeness [%] | 96.8 | 96.1 |
Redundancy | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |