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1NY3

Crystal structure of ADP bound to MAP KAP kinase 2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.1
Synchrotron siteALS
Beamline5.0.1
Temperature [K]100
Detector technologyCCD
Collection date2002-06-15
DetectorADSC QUANTUM 4
Wavelength(s)1.0
Spacegroup nameF 41 3 2
Unit cell lengths253.049, 253.049, 253.049
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 3.200

*

R-factor0.25913
Rwork0.259
R-free0.29200

*

Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1nzk
RMSD bond length0.022

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RMSD bond angle1.650

*

Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.1.19)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0003.110
High resolution limit [Å]3.100

*

3.000
Rmerge0.055

*

0.631

*

Total number of observations90852

*

Number of reflections12997

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<I/σ(I)>32.12.29
Completeness [%]99.3

*

100

*

Redundancy6.9621
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

7.5

*

2962.0M Ammonium Sulfate, pH unbuffered, VAPOR DIFFUSION, HANGING DROP, temperature 296K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein5 (mg/ml)
21reservoirHEPES20 (mM)pH7.5
31reservoir200 (mM)
41reservoirdithiothreitol10 (mM)
51reservoir5 (mM)

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