Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

8BR5

Discovery of IRAK4 Inhibitor 41

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyPIXEL
Collection date2017-08-30
DetectorDECTRIS PILATUS 6M
Wavelength(s)1.000
Spacegroup nameC 1 2 1
Unit cell lengths143.214, 141.199, 87.919
Unit cell angles90.00, 124.46, 90.00
Refinement procedure
Resolution90.583 - 2.700
Rwork0.215
R-free0.25410
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)in house model
RMSD bond length0.004
RMSD bond angle1.253
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]90.5832.950
High resolution limit [Å]2.7002.700
Rmeas0.0940.523
Number of reflections394889173
<I/σ(I)>16.83.58
Completeness [%]99.3
Redundancy4.42
CC(1/2)0.9980.882
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP293none

222926

PDB entries from 2024-07-24

PDB statisticsPDBj update infoContact PDBjnumon