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2NY1

HIV-1 gp120 Envelope Glycoprotein (I109C, T257S, S334A, S375W, Q428C) Complexed with CD4 and Antibody 17b

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyCCD
Collection date2003-02-13
DetectorMAR CCD 225 mm
Spacegroup nameP 2 2 21
Unit cell lengths71.113, 88.156, 197.672
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.400 - 1.990
R-factor0.21081
Rwork0.209
R-free0.24975
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1gc1
RMSD bond length0.006
RMSD bond angle1.007
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0002.070
High resolution limit [Å]1.9904.3101.990
Rmerge0.1260.0750.580
Number of reflections74094
<I/σ(I)>6.1
Completeness [%]87.199.863.2
Redundancy6.27.43
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.62987.5% PEG 8000, 7.5% MPD, 100 mM Na Citrate , pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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