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4LSP

Crystal structure of broadly and potently neutralizing antibody VRC-CH31 in complex with HIV-1 clade A/E gp120 93TH057

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyCCD
Collection date2011-06-07
DetectorMARMOSAIC 300 mm CCD
Spacegroup nameP 21 21 21
Unit cell lengths67.392, 83.958, 175.734
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.040 - 2.150
R-factor0.182
Rwork0.180
R-free0.21400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3se9
RMSD bond length0.005
RMSD bond angle0.948
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwarePHENIX (dev_1317)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.230
High resolution limit [Å]2.1502.150
Rmerge0.0840.519
Number of reflections52604
<I/σ(I)>10.8
Completeness [%]95.871.6
Redundancy5.72.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
18.52930.1M Tris, 15% PEG 4000,0.1 M Li2SO4, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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