1ODA

N-terminal of Sialoadhesin in complex with Me-a-9-N-(biphenyl-4-carbonyl)-amino-9-deoxy-Neu5Ac (BIP compound)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SRS BEAMLINE PX14.2
Synchrotron site	SRS
Beamline	PX14.2
Temperature [K]	110
Detector technology	CCD
Detector	MARRESEARCH
Spacegroup name	P 43 21 2
Unit cell lengths	66.610, 66.610, 66.947
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.260 - 3.310
R-factor	0.217
Rwork	0.217
R-free	0.28400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	DOMAIN A OF PDB ENTRY 1QFO
RMSD bond length	0.008
RMSD bond angle	1.400
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	3.420
High resolution limit [Å]	3.300	3.300
Rmerge	0.192	0.320
Number of reflections	2271
<I/σ(I)>	9.2	1.8
Completeness [%]	89.7	18.1
Redundancy	5.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		5.6		ONE + ONE DROP WITH 30 % (W/V) PEG 4000, 10 MM DTT, 0.2M AMMONIUM ACETATE, 0.1M SODIUM CITRATE PH 5.6,2.5MM BIP COMPOUND