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1RZ7

CRYSTAL STRUCTURE OF HUMAN ANTI-HIV-1 GP120-REACTIVE ANTIBODY 48D

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X4A
Synchrotron siteNSLS
BeamlineX4A
Temperature [K]100
Detector technologyCCD
Collection date2001-03-15
DetectorADSC QUANTUM 4
Wavelength(s)0.9794
Spacegroup nameP 21 21 21
Unit cell lengths63.485, 72.951, 101.921
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.000
R-factor0.2011
Rwork0.201
R-free0.23100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1dfb
RMSD bond length0.005
RMSD bond angle1.386

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Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.060

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Total number of observations230911

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Number of reflections32647
<I/σ(I)>21.9
Completeness [%]99.8

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100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7

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2938.3% PEG4000, 8.3% isopropanol, 0.33M NaCl, 0.04M sodium citrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropTris-HCl2.5 (mM)
21drop0.35 (M)
31drop0.02 (%(v/v))pH7.0
41dropprotein4-8 (mg/ml)
51reservoirPEG40008.3 (%)
61reservoirisopropyl alcohol8.3 (%)
71reservoir0.33 (M)
81reservoirsodium citrate0.04 (M)pH5.6

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