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1GM6

3-D STRUCTURE OF A SALIVARY LIPOCALIN FROM BOAR

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-2
Synchrotron siteESRF
BeamlineID14-2
Temperature [K]100
Collection date2001-01-15
Spacegroup nameP 41 21 2
Unit cell lengths70.112, 70.112, 71.750
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution15.000

*

- 2.130
R-factor0.252

*

Rwork0.254
R-free0.28300

*

Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ew3
RMSD bond length0.011
RMSD bond angle1.400

*

Data reduction softwareDENZO
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]28.800

*

2.150
High resolution limit [Å]2.1002.100
Rmerge0.0560.295

*

Number of reflections10884
<I/σ(I)>7.33
Completeness [%]99.699.6
Redundancy3.94
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

5.51.95M AS, 0.1M NACI PH 5.5, 0.2M K/NA TARTRATE
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirammonium sulfate1.95 (M)
21reservoirsodium citrate0.1 (M)pH5.5
31reservoirpotassium/sodium tartrate0.2 (M)
41dropprotein3 (mg/ml)
51drop10 (mM)

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