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1IDB

Crystal structures of HIV-2 protease in complex with inhibitors containing the hydroxyethylamine dipeptide isostere

Experimental procedure
Spacegroup nameP 43 21 2
Unit cell lengths62.600, 62.600, 115.800
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution6.000 - 2.200
R-factor0.18
Rwork0.180
RMSD bond length0.017
RMSD bond angle2.600
Phasing softwareX-PLOR
Refinement softwareTNT
Data quality characteristics
 Overall
Number of reflections10200

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Completeness [%]87.0

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Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

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5.4

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Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein6 (mg/ml)
21dropphosphate10 (%(v/v))
31drop0.02 (%(w/v))
41reservoir0.3-0.5 (M)
51reservoirsodium acetate0.1 (M)
61reservoir0.02 (%(w/v))

220113

PDB entries from 2024-05-22

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