PDB-2pet: Lutheran glycoprotein, N-terminal domains 1 and 2.

ID or keywords:

Entry

Database: PDB / ID: 2pet

Title

Lutheran glycoprotein, N-terminal domains 1 and 2.

Components

Lutheran blood group glycoprotein

Keywords

CELL ADHESION / Immunoglobulin superfamily.

Function / homology

Function and homology information

laminin receptor activity / laminin binding / cell-matrix adhesion / transmembrane signaling receptor activity / collagen-containing extracellular matrix / cell adhesion / external side of plasma membrane / signal transduction / extracellular exosome / extracellular region / plasma membrane
Similarity search - Function

Biological species

Homo sapiens (human)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MIRAS / Resolution: 1.7 Å

Authors

Burton, N. / Brady, R.L.

Citation

Journal: Blood / Year: 2007
Title: The Laminin 511/521-binding site on the Lutheran blood group glycoprotein is located at the flexible junction of Ig domains 2 and 3.
Authors: Mankelow, T.J. / Burton, N. / Stefansdottir, F.O. / Spring, F.A. / Parsons, S.F. / Pedersen, J.S. / Oliveira, C.L. / Lammie, D. / Wess, T. / Mohandas, N. / Chasis, J.A. / Brady, R.L. / Anstee, D.J.

History

Deposition	Apr 3, 2007	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Dec 4, 2007	Provider: repository / Type: Initial release
Revision 1.1	Jul 13, 2011	Group: Advisory / Version format compliance

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	2pet.cif.gz	64.6 KB	Display	PDBx/mmCIF format
PDB format	pdb2pet.ent.gz	51.5 KB	Display	PDB format
PDBx/mmJSON format	2pet.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Summary document	2pet_validation.pdf.gz	422.5 KB	Display	wwPDB validaton report
Full document	2pet_full_validation.pdf.gz	423.4 KB	Display
Data in XML	2pet_validation.xml.gz	12.9 KB	Display
Data in CIF	2pet_validation.cif.gz	19.1 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/pe/2pet ftp://data.pdbj.org/pub/pdb/validation_reports/pe/2pet	HTTPS FTP

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Related structure data

Related structure data	2pf6C C: citing same article (ref.)
Similar structure data	2pf6-1 4fs0-d 6bbt-2 2pf6-2 3zrx-d 4uj8-2 5a2f-d 6bbt-1 4lp5-1 1qd0-2 Search similar-shape structures by Omokage search (details) Similarity search - Function & homologyF&H Search Similarity search - FunctionF&H Search Similarity search - HomologyF&H Search

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#21 - Sep 2001 Antibodies similarity (1) #256 - Apr 2021 SARS-CoV-2 Spike and Antibodies similarity (1) #204 - Dec 2016 PD-1 similarity (2) #186 - Jun 2015 Receptor for Advanced Glycation End Products similarity (3) #247 - Jul 2020 Myelin-associated Glycoprotein similarity (3) #20 - Aug 2001 Poliovirus and Rhinovirus similarity (2) #231 - Mar 2019 Measles Virus Proteins similarity (2) #267 - Mar 2022 Vascular Endothelial Growth Factor (VegF similarity (1)

PDB pages

PDBj /

wwPDB /

NCBI

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Deposited unit

A: Lutheran blood group glycoprotein

25.6 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

Idetical with deposited unit
defined by author

Unit cell

Length a, b, c (Å)	32.955, 111.062, 35.301
Angle α, β, γ (deg.)	90.000, 90.450, 90.000
Int Tables number	4
Cell setting	monoclinic
Space group name H-M	P12₁1

Details

Asymmetric unit contains one copy of the biological unit.

#1: Antibody	Lutheran blood group glycoprotein / B-CAM cell surface glycoprotein / Auberger B antigen / F8/G253 antigen / CD239 antigen Mass: 25647.830 Da / Num. of mol.: 1 / Fragment: N-terminal domains 1 and 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Homo sapiens (human) / Gene: BCAM, LU, MSK19 / Plasmid: pEE / References: UniProt: P50895
#2: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 211 / Source method: isolated from a natural source / Formula: H₂O

#1: Antibody

Lutheran blood group glycoprotein / B-CAM cell surface glycoprotein / Auberger B antigen / F8/G253 antigen / CD239 antigen

Mass: 25647.830 Da / Num. of mol.: 1 / Fragment: N-terminal domains 1 and 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Homo sapiens (human) / Gene: BCAM, LU, MSK19 / Plasmid: pEE / References: UniProt: P50895

#2: Water

ChemComp-HOH / water

Mass: 18.015 Da / Num. of mol.: 211 / Source method: isolated from a natural source / Formula: H₂O

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Experiment

Experiment	Method: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

Crystal	Density Matthews: 2.52 Å³/Da / Density % sol: 51.14 %
Crystal grow	Temperature: 291 K / Method: vapor diffusion, hanging drop / pH: 6.4 Details: 12% PEG 20000, 6% heaxane-1,2-diol, 0.1M MES, pH 6.4, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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Data collection

Diffraction

ID	Mean temperature (K)	Crystal-ID
1	100	1
2		1
3		1
4		1

Diffraction source

Source:

SYNCHROTRON / Site:

SRS

/ Beamline: PX10.1 / Wavelength: 1.285 Å

Detector

Type: MARMOSAIC 225 mm CCD / Detector: CCD / Date: Oct 10, 2006

Radiation

Monochromator: SAGITALLY FOCUSED Si(111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray

Radiation wavelength

Wavelength: 1.285 Å / Relative weight: 1

Reflection

D res low: 50 Å

Redundancy (%)	ID	Av σ(I) over netI	Number	R_merge(I) obs	Χ²	D res high (Å)	Num. obs	% possible obs
6.8	1	10	58600	0.118	0.98	2.5	8593	93.6
5.9	2	11.8	46293	0.089	0.95	2.5	7832	85.4
8.8	3	9.5	190018	0.098	0.86	1.8	21471	89.9
8.9	4	16.1	192371	0.069	0.94	1.8	21542	90.5

Diffraction reflection shell

Highest resolution (Å)	Lowest resolution (Å)	% possible obs (%)	ID	R_merge(I) obs	Chi squared	Redundancy
5.38	50	99.8	1	0.108	1.7	8.2
4.27	5.38	100	1	0.102	1.355	8.6
3.73	4.27	100	1	0.112	1.126	8.5
3.39	3.73	100	1	0.122	0.929	8.4
3.15	3.39	100	1	0.141	0.739	7.9
2.96	3.15	98.2	1	0.162	0.642	7.1
2.82	2.96	96.7	1	0.182	0.528	5.8
2.69	2.82	90.4	1	0.224	0.563	4.9
2.59	2.69	81	1	0.229	0.454	3.8
2.5	2.59	70.3	1	0.263	0.452	3
5.38	50	99.4	2	0.064	1.788	7.5
4.27	5.38	100	2	0.078	1.368	7.7
3.73	4.27	100	2	0.093	0.935	7.7
3.39	3.73	100	2	0.113	0.748	7.4
3.15	3.39	99.9	2	0.146	0.579	6.8
2.96	3.15	97.3	2	0.174	0.456	5.5
2.82	2.96	89.2	2	0.204	0.409	4.1
2.69	2.82	75.2	2	0.305	0.64	3.1
2.59	2.69	55.9	2	0.284	0.35	2.2
2.5	2.59	36.3	2	0.326	0.327	1.8
3.88	50	100	3	0.08	1.753	10.6
3.08	3.88	100	3	0.086	1.206	10.7
2.69	3.08	100	3	0.094	0.858	10.7
2.44	2.69	99.9	3	0.117	0.674	10.5
2.27	2.44	99.2	3	0.133	0.623	10
2.13	2.27	98.5	3	0.147	0.566	9.2
2.03	2.13	93.5	3	0.161	0.502	8.2
1.94	2.03	85.3	3	0.184	0.469	6.8
1.86	1.94	70.1	3	0.216	0.461	4.4
1.8	1.86	51.9	3	0.232	0.437	2.8
3.88	50	100	4	0.056	1.59	10.3
3.08	3.88	100	4	0.059	1.346	10.4
2.69	3.08	100	4	0.064	0.994	10.4
2.44	2.69	100	4	0.081	0.828	10.3
2.27	2.44	99.9	4	0.093	0.758	10.1
2.13	2.27	99.5	4	0.109	0.678	9.8
2.03	2.13	97.4	4	0.125	0.621	8.9
1.94	2.03	87.5	4	0.145	0.655	6.6
1.86	1.94	70.6	4	0.167	0.59	4.7
1.8	1.86	49.6	4	0.2	0.574	3.3

Reflection

Resolution: 1.7→55.64 Å / Num. all: 24823 / Num. obs: 24823 / % possible obs: 89.1 % / Observed criterion σ(F): -3 / Observed criterion σ(I): -3 / Redundancy: 6.4 % / B_iso Wilson estimate: 19.2 Å² / R_merge(I) obs: 0.059 / Χ²: 0.913 / Net I/σ(I): 13.3

Reflection shell

Resolution: 1.7→1.76 Å / Redundancy: 2 % / R_merge(I) obs: 0.264 / Mean I/σ(I) obs: 2.49 / Num. unique all: 1354 / Χ²: 0.88 / % possible all: 48.3

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Phasing

Phasing

Method:

MIRAS

Phasing dm

Method: Solvent flattening and Histogram matching / Reflection: 24792

Phasing dm shell

Resolution (Å)	Delta phi final	FOM	Reflection
6.56-100	53.5	0.874	502
5.19-6.56	50.7	0.892	504
4.52-5.19	53.2	0.903	510
4.06-4.52	52.7	0.895	560
3.71-4.06	54.2	0.877	624
3.44-3.71	56.5	0.864	693
3.22-3.44	57	0.847	723
3.04-3.22	57.6	0.866	789
2.89-3.04	56.8	0.844	819
2.76-2.89	55.7	0.802	854
2.64-2.76	56.9	0.82	914
2.54-2.64	59.7	0.816	901
2.45-2.54	78.4	0.643	1017
2.36-2.45	90.6	0.495	971
2.29-2.36	91.6	0.555	1057
2.22-2.29	87.9	0.518	1056
2.16-2.22	88.6	0.516	1110
2.1-2.16	88.9	0.521	1131
2.05-2.1	90	0.555	1131
2-2.05	89.8	0.589	1194
1.96-2	90.5	0.589	1147
1.91-1.96	88.8	0.551	1129
1.87-1.91	90	0.56	1098
1.84-1.87	91.6	0.514	1018
1.8-1.84	89.8	0.51	1006
1.77-1.8	91.4	0.542	864
1.73-1.77	89	0.462	740
1.7-1.73	89.6	0.438	730

Phasing MIR

Resolution: 1.7→55.64 Å / FOM: 0.735 / Reflection: 8805 / Reflection criterion: FP >3.0 SIGFP

Phasing MIR der

Der set-ID: 1 / Reflection criteria: FPH >3.0 SIGFPH

ID	Resolution (Å)	R cullis acentric	R cullis anomalous	R cullis centric	Num. of sites	Power acentric	Power centric	Reflection acentric	Reflection anomalous	Reflection centric
Ptpeak	3-50	0.85	0.95	0.91	3	0.96	0.71	4881	4855	197
Ptlr	3-50	0.87	0.97	0.92	3	0.92	0.68	4875	4866	196
Auhr	2.5-50	0.51	0.83	0.65	1	3.05	1.71	8511	8509	293
Aulr	2.5-50	0.52	0.88	0.67	1	2.97	1.62	8510	8510	294

Phasing MIR der site

ID	Der-ID	B_iso (Å)	Atom type symbol	Fract x	Fract y	Fract z	Occupancy anom	Occupancy anom su	Occupancy iso	Occupancy iso su
1	Ptpeak	88.666	Pt	0.346	-0.063	0.029	0.701	0.055	1.149	0.079
2	Ptpeak	39.463	Pt	0.661	0.135	-0.081	0.4	0.032	0.497	0.056
3	Ptpeak	42.636	Pt	0.141	0.18	0.322	0.58	0.034	0.928	0.058
4	Ptlr	74.646	Pt	0.346	-0.062	0.029	0.248	0.023	1	0.076
5	Ptlr	25.972	Pt	0.661	0.135	-0.083	0.176	0.015	0.434	0.053
6	Ptlr	37.772	Pt	0.141	0.18	0.323	0.278	0.017	0.871	0.058
7	Auhr	16.176	Au	0.152	0.026	0.298	0.627	0.01	0.888	0.014
8	Aulr	15.256	Au	0.152	0.026	0.298	0.283	0.005	0.804	0.014

Phasing MIR shell

Resolution (Å)	FOM	FOM acentric	FOM centric	Reflection	Reflection acentric	Reflection centric
11.19-55.64	0.83	0.82	0.894	97	84	13
6.22-11.19	0.816	0.81	0.9	488	455	33
4.31-6.22	0.787	0.779	0.952	1158	1104	54
3.29-4.31	0.742	0.736	0.926	2128	2062	66
2.67-3.29	0.714	0.708	0.919	3384	3291	93
2.24-2.67	0.701	0.696	0.9	1550	1515	35
1.93-2.24
1.7-1.93

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Processing

Software

Name	Version	Classification
MLPHARE	CCP4_5.99	phasing
HKL-2000		data collection
HKL-2000		data reduction
HKL-2000		data scaling
REFMAC	5.2.0019	refinement

Refinement

Method to determine structure:

MIRAS / Resolution: 1.7→55.64 Å / Cor.coef. F_o:F_c: 0.963 / Cor.coef. F_o:F_c free: 0.945 / WR_factor R_free: 0.209 / WR_factor R_work: 0.168 / SU B: 4.56 / SU ML: 0.077 / TLS residual ADP flag: LIKELY RESIDUAL / Isotropic thermal model: TLS / Cross valid method: THROUGHOUT / σ(F): 0 / ESU R: 0.112 / ESU R Free: 0.113
Stereochemistry target values: MAXIMUM LIKELIHOOD WITH PHASES
Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.21	1229	5 %	RANDOM
R_work	0.168	-	-	-
all	0.17	24792	-	-
obs	0.17	24792	88.8 %	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.4 Å / Solvent model: BABINET MODEL WITH MASK

Displacement parameters

B_iso mean: 21.165 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-0.46 Å²	0 Å²	-0.57 Å²
2-	-	-1.77 Å²	0 Å²
3-	-	-	2.22 Å²

Refine analyze

	Free	Obs
Luzzati coordinate error	0.113 Å	0.112 Å

Refinement step

Cycle: LAST / Resolution: 1.7→55.64 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	1796	0	0	211	2007

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.015	0.021	1942
X-RAY DIFFRACTION	r_angle_refined_deg	1.678	1.965	2665
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	6.615	5	266
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	36.093	22.609	92
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	13.919	15	336
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	17.458	15	23
X-RAY DIFFRACTION	r_chiral_restr	0.121	0.2	299
X-RAY DIFFRACTION	r_gen_planes_refined	0.007	0.02	1515
X-RAY DIFFRACTION	r_nbd_refined	0.215	0.2	786
X-RAY DIFFRACTION	r_nbtor_refined	0.306	0.2	1307
X-RAY DIFFRACTION	r_xyhbond_nbd_refined	0.121	0.2	191
X-RAY DIFFRACTION	r_symmetry_vdw_refined	0.25	0.2	52
X-RAY DIFFRACTION	r_symmetry_hbond_refined	0.192	0.2	12
X-RAY DIFFRACTION	r_mcbond_it	1.005	1.5	1247
X-RAY DIFFRACTION	r_mcangle_it	1.495	2	1971
X-RAY DIFFRACTION	r_scbond_it	2.142	3	780
X-RAY DIFFRACTION	r_scangle_it	3.255	4.5	676

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 20

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Num. reflection all	% reflection obs (%)
1.699-1.743	0.368	41	0.278	867	2062	44.035
1.743-1.79	0.268	60	0.242	1121	1984	59.526
1.79-1.842	0.305	79	0.216	1357	1965	73.079
1.842-1.899	0.223	70	0.197	1451	1858	81.862
1.899-1.961	0.21	70	0.181	1619	1885	89.602
1.961-2.03	0.248	72	0.167	1630	1758	96.815
2.03-2.106	0.239	88	0.171	1587	1714	97.725
2.106-2.192	0.2	75	0.163	1610	1692	99.586
2.192-2.289	0.199	85	0.171	1460	1547	99.871
2.289-2.401	0.22	76	0.171	1433	1511	99.868
2.401-2.531	0.191	76	0.181	1409	1485	100
2.531-2.684	0.217	69	0.176	1273	1342	100
2.684-2.869	0.225	60	0.165	1194	1254	100
2.869-3.098	0.207	65	0.158	1145	1210	100
3.098-3.392	0.216	55	0.15	1050	1105	100
3.392-3.791	0.172	50	0.145	944	994	100
3.791-4.374	0.185	50	0.142	848	898	100
4.374-5.349	0.173	40	0.149	699	739	100
5.349-7.53	0.261	33	0.194	547	580	100
7.53-55.641	0.197	15	0.209	319	335	99.701

Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

ID	L11 (°²)	L12 (°²)	L13 (°²)	L22 (°²)	L23 (°²)	L33 (°²)	S11 (Å °)	S12 (Å °)	S13 (Å °)	S21 (Å °)	S22 (Å °)	S23 (Å °)	S31 (Å °)	S32 (Å °)	S33 (Å °)	T11 (Å²)	T12 (Å²)	T13 (Å²)	T22 (Å²)	T23 (Å²)	T33 (Å²)	Origin x (Å)	Origin y (Å)	Origin z (Å)
1	20.3582	15.9816	0.7241	39.1015	17.01	10.2054	-1.2201	2.1265	0.5145	-1.8364	0.595	1.0638	-0.8353	0.5753	0.6251	0.1277	-0.0915	-0.099	0.223	0.0027	0.0104	-30.104	24.933	16.31
2	2.1616	2.6611	0.8674	3.5377	1.5424	1.2088	-0.0344	-0.06	0.2393	0.0487	-0.1362	0.2364	-0.0863	-0.1586	0.1706	0.026	-0.0014	0.0003	0.0517	-0.0281	0.0649	-19.951	35.657	27.865
3	20.9144	11.0983	3.6426	9.5872	3.3882	3.8569	0.1535	-0.5382	-0.5123	-0.1003	-0.2679	-0.0789	-0.1286	-0.5956	0.1145	0.0034	-0.0091	0.0076	0.1643	0.016	-0.0398	-26.697	19.067	27.075
4	32.1616	0.8358	-18.6614	1.7174	3.303	19.2903	0.2535	0.7201	1.9511	-0.6954	0.9579	0.5917	-0.8377	0.2521	-1.2114	0.1082	-0.1197	0.0669	0.1338	0.0279	0.1141	-8.28	25.449	20.492
5	7.0038	-1.9773	-8.683	1.0426	0.8746	33.6311	-0.1833	-0.213	-0.5838	0.0168	-0.1348	0.2033	0.7135	0.5317	0.3182	-0.0068	0.0086	0.0227	0.0059	0.0053	0.0574	-12.067	21.247	25.831
6	47.7324	9.2507	1.0865	5.7536	-3.8749	16.7427	-0.3386	-0.7951	-0.7204	-0.0084	0.8761	0.3479	0.11	-1.6206	-0.5375	-0.032	-0.0255	0.0201	0.2661	0.1417	0.0116	-29.117	16.679	33.193
7	1.1873	3.0174	-2.2238	8.5875	-5.8298	4.1998	0.0417	-0.089	-0.5219	0.564	-0.5299	-1.0206	-0.3073	0.1156	0.4882	0.0445	-0.0089	-0.0482	0.047	0.0487	0.1298	-13.871	21.883	36.702
8	9.9526	7.1336	0.2836	5.8129	-0.1624	3.3647	0.2184	-0.1382	0.4657	0.443	-0.1877	0.2023	-0.2299	-0.2013	-0.0306	0.0524	-0.0037	0.0235	0.0377	-0.0101	0.0276	-20.321	28.822	34.861
9	3.2664	3.7217	1.9091	5.9186	2.8131	1.7992	0.0777	0.105	-0.2524	0.0144	-0.0632	-0.3291	-0.0032	-0.0907	-0.0145	0.0171	-0.0294	0.0147	0.0654	-0.0143	0.0307	-16.747	27.511	25.042
10	12.4645	9.7501	6.0439	7.8628	4.1499	4.3462	0.036	0.1952	-0.1084	0.0372	0.2281	-0.2945	0.116	0.1792	-0.2641	0.0266	0.0045	0.0085	0.0476	-0.0174	0.0966	-7.437	43.713	28.993
11	10.6182	5.9845	-1.1535	3.3734	-0.6786	1.7558	0.1618	-0.3887	-0.1731	0.0943	-0.2538	-0.0318	-0.0493	0.1972	0.092	0.0292	0.0208	0.036	0.0692	-0.0019	0.012	16.182	62.538	30.857
12	5.8272	9.2107	-4.9564	14.8025	-9.259	12.5389	0.2195	-0.4088	-0.1898	0.0646	-0.3876	-0.2207	0.5621	1.3304	0.1681	-0.0117	-0.0015	0.0472	0.221	0.0097	-0.0214	23.338	67.282	19.491
13	3.5384	2.4799	-0.3538	1.9364	-0.5847	0.6071	-0.026	0.023	-0.2543	-0.1012	0.0004	-0.0809	0.0022	0.021	0.0256	0.0389	0.0045	0.0223	0.0461	-0.0125	0.0966	5.239	53.697	27.263
14	7.408	-7.4131	-0.6493	8.6289	-1.8095	5.0522	0.3098	0.5748	0.3472	-0.0636	-0.1087	0.1979	0.0606	-0.3548	-0.2011	0.0121	0.0149	-0.0301	0.0487	0.0485	0.085	4.007	67.465	21.116
15	24.1353	16.3241	0.9098	14.1706	1.1513	12.9513	-1.192	1.8458	-1.4118	-2.2767	1.5166	-0.47	0.2905	0.6527	-0.3246	0.2942	-0.0664	0.0416	0.1219	-0.1187	-0.0688	14.035	59.551	12.991
16	8.5736	10.6344	-4.0542	13.2441	-5.7798	12.4614	-0.5903	0.1838	-0.6435	-1.1112	-0.1259	-0.3245	1.3021	-0.1779	0.7162	0.1833	-0.0125	0.0609	-0.0282	-0.0607	0.0152	11.566	53.502	19.82
17	3.3334	4.1396	-1.7913	6.353	-2.6175	1.09	-0.028	0.0714	-0.3732	-0.0741	-0.0814	-0.2323	-0.0885	-0.0012	0.1094	0.0516	-0.0014	0.0182	0.0465	-0.0042	0.0782	7.116	47.332	27.108
18	2.9508	1.2241	-0.6033	2.1421	-0.6012	0.5014	0.0032	0.1016	0.2043	-0.079	-0.0029	0.1155	-0.1023	-0.0856	-0.0003	0.0776	0.0054	0.0065	0.0397	0.0151	0.0222	10.992	69.512	24.595
19	11.5154	2.5175	2.1426	12.9538	-3.6551	1.7695	0.1089	0.0298	0.2205	0.1778	-0.0943	-0.2168	0.1842	-0.0257	-0.0146	-0.014	-0.0131	0.0137	0.0509	-0.0019	0.1023	-11.154	51.567	26.569
20	12.3194	7.9718	0.5199	5.4374	0.6656	0.5395	0.0893	-0.2289	0.2717	0.0201	-0.1053	0.3072	-0.1248	0.026	0.0159	0.0364	0.0057	0.0258	0.0447	0.019	0.0317	10.98	66.615	31.34

Refinement TLS group

Refine-ID: X-RAY DIFFRACTION / Selection: ALL / Auth asym-ID: A / Label asym-ID: A

ID	Refine TLS-ID	Auth seq-ID	Label seq-ID
1	1	1 - 4	1 - 4
2	2	5 - 27	5 - 27
3	3	28 - 35	28 - 35
4	4	36 - 42	36 - 42
5	5	43 - 48	43 - 48
6	6	49 - 56	49 - 56
7	7	57 - 70	57 - 70
8	8	71 - 82	71 - 82
9	9	83 - 108	83 - 108
10	10	109 - 118	109 - 118
11	11	119 - 130	119 - 130
12	12	131 - 136	131 - 136
13	13	137 - 154	137 - 154
14	14	155 - 163	155 - 163
15	15	164 - 171	164 - 171
16	16	172 - 176	172 - 176
17	17	177 - 192	177 - 192
18	18	193 - 209	193 - 209
19	19	210 - 218	210 - 218
20	20	219 - 231	219 - 231

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