1R3S

Uroporphyrinogen Decarboxylase single mutant D86G in complex with coproporphyrinogen-I

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2003-06-15
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	102.947, 102.947, 72.585
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 * - 1.650
R-factor	0.16321
Rwork	0.163
R-free	0.19000
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	1uro
RMSD bond length	0.014
RMSD bond angle	1.845
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000 *	1.710
High resolution limit [Å]	1.650	1.650
Rmerge	0.072	0.236
Total number of observations	260521 *
Number of reflections	51852 *
<I/σ(I)>	10	1.8
Completeness [%]	96.6 *	75.2 *
Redundancy	5	5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, sitting drop *	7.5 *	21 *	Phillips, J.D., (1997) Protein Sci., 6, 1343. *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	6 (mg/ml)
2	1	drop	Tris	50 (mM)	pH7.5
3	1	drop	glycerol	10 (%)
4	1	drop	beta-mercaptoethanol	1 (mM)
5	1	reservoir	MPD	16 (%)
6	1	reservoir	MES	0.1	pH6.0