5YR5

Human methionine aminopeptidase type 1b (F309L mutant) in complex with Ovalicin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2017-03-19
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	47.392, 77.339, 47.464
Unit cell angles	90.00, 87.95, 90.00

Refinement procedure

Resolution	31.240 - 1.600
R-factor	0.1782
Rwork	0.177
R-free	0.20120
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2gz5
RMSD bond length	0.013
RMSD bond angle	1.726
Data reduction software	DENZO (2.3.1)
Data scaling software	SCALEPACK (2.2.0)
Phasing software	MOLREP (11.5.05)
Refinement software	REFMAC (5.8.0230)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.660
High resolution limit [Å]	1.600	3.450	1.600
Rmerge	0.056	0.036	0.427
Rmeas	0.065	0.042	0.514
Rpim	0.034	0.022	0.280
Number of reflections	45241	4615	4450
<I/σ(I)>	17.3
Completeness [%]	99.8	99.8	98.1
Redundancy	3.6	3.7	3.3
CC(1/2)		0.998	0.844

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.2	298	0.1M Bistris pH-6.2, 19% PEG3350, 5% glycerol