6BTP

BMP1 complexed with a hydroxamate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	93
Detector technology	CCD
Collection date	2013-11-04
Detector	RIGAKU SATURN A200
Wavelength(s)	1.54
Spacegroup name	P 21 21 21
Unit cell lengths	90.331, 124.366, 43.642
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.090 - 1.930
R-factor	0.2041
Rwork	0.203
R-free	0.23330
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.223
Data reduction software	HKL-2000
Data scaling software	SCALA
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	124.366	10.000	2.030
High resolution limit [Å]	1.927	6.090	1.930
Rmerge		0.027	0.606
Rmeas	0.126	0.033	0.704
Rpim	0.046	0.013	0.256
Total number of observations	267447
Number of reflections	36873	1332	5168
<I/σ(I)>	17.1	23.2	1.3
Completeness [%]	97.0	98.9	94.7
Redundancy	7.3	6.3	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277	8-12% PEG 3350 150-200mM KSCN 10mM spermidine