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7OIL

mPI3Kd in complex with compound 58

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU FR-E
Temperature [K]100
Detector technologyCCD
Collection date2015-08-20
DetectorRIGAKU SATURN A200
Wavelength(s)1.542
Spacegroup nameC 1 2 1
Unit cell lengths142.010, 64.750, 116.380
Unit cell angles90.00, 103.39, 90.00
Refinement procedure
Resolution31.127 - 1.950
Rwork0.239
R-free0.28930
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)Internal Model
RMSD bond length0.010
RMSD bond angle1.665
Data reduction softwareMOSFLM
Data scaling softwareAimless
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]31.1301.990
High resolution limit [Å]1.9501.950
Rmerge0.1391.319
Number of reflections751514003
<I/σ(I)>6.2
Completeness [%]99.2
Redundancy3.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION293ethylene glycol per PEG 8000, carboxylic acids mix, buffer system 2,

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