2ARR
Human plasminogen activator inhibitor-2.[loop (66-98) deletion mutant] complexed with peptide n-acetyl-teaaagmggvmtgr-oh
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2000-12-20 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 91.952, 103.802, 41.406 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.700 - 1.550 |
R-factor | 0.18745 |
Rwork | 0.186 |
R-free | 0.21998 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1jrr |
RMSD bond length | 0.019 |
RMSD bond angle | 1.676 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.700 | 1.630 |
High resolution limit [Å] | 1.550 | 1.550 |
Number of reflections | 56875 | |
<I/σ(I)> | 20.7 | 2.6 |
Completeness [%] | 97.4 | 84.5 |
Redundancy | 7.6 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | peg 8K, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |