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9LJ3

Crystal structure of P25

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL18U1
Synchrotron siteSSRF
BeamlineBL18U1
Temperature [K]193.15
Detector technologyPIXEL
Collection date2024-06-23
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.979460
Spacegroup nameP 1 21 1
Unit cell lengths70.422, 77.159, 78.099
Unit cell angles90.00, 97.98, 90.00
Refinement procedure
Resolution34.870 - 3.150
R-factor0.2478
Rwork0.243
R-free0.28520
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5c3t
RMSD bond length0.003
RMSD bond angle0.646
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHENIX
Refinement softwarePHENIX ((1.20.1_4487: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.8703.263
High resolution limit [Å]3.1503.150
Number of reflections278211454
<I/σ(I)>8.37
Completeness [%]99.2
Redundancy6.7
CC(1/2)0.9930.859
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP289.150.2 M Sodium phosphate dibasic dihydrate,pH 9.1 20% w/v Polyethylene glycol 3,350

246031

PDB entries from 2025-12-10

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