4DGE

TRIMCyp cyclophilin domain from Macaca mulatta: H70C mutant, HIV-1 CA(O-loop) complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2010-07-29
Detector	RIGAKU RAXIS HTC
Wavelength(s)	1.5418
Spacegroup name	P 1
Unit cell lengths	39.070, 59.710, 70.470
Unit cell angles	65.08, 83.87, 79.65

Refinement procedure

Resolution	63.870 - 2.200
R-factor	0.1894
Rwork	0.186
R-free	0.25500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB ENTRIES 2WLW AND 1AK4
RMSD bond length	0.013
RMSD bond angle	1.374
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.16)
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	63.870	38.411	2.320
High resolution limit [Å]	2.200	6.960	2.200
Rmerge		0.028	0.144
Total number of observations		1486	6099
Number of reflections	27012
<I/σ(I)>	9.4	20.5	4.9
Completeness [%]	93.8	89.1	89.1
Redundancy	1.7	1.8	1.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.6	290	23.5% w/v PEG8000, 0.1 M HEPES, pH 7.6, VAPOR DIFFUSION, SITTING DROP, temperature 290K