1R3T

Uroporphyrinogen Decarboxylase single mutant D86G in complex with coproporphyrinogen-III

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 IIC
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	102.680, 102.680, 73.130
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 * - 1.700
R-factor	0.17019
Rwork	0.169
R-free	0.20000 *
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	1uro
RMSD bond length	0.015
RMSD bond angle	1.547
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000 *	1.760
High resolution limit [Å]	1.700	1.700
Rmerge	0.096	0.232
Total number of observations	230692 *
Number of reflections	47218
<I/σ(I)>	13	2.7
Completeness [%]	95.7 *	87.5 *
Redundancy	4.9	4.9

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