PDB-2qp2: Structure of a MACPF/perforin-like protein

ID or keywords:

Entry

Database: PDB / ID: 2qp2

Title

Structure of a MACPF/perforin-like protein

Components

Unknown protein

Keywords

UNKNOWN FUNCTION / Toxin

Function / homology

Function and homology information

metal ion binding
Similarity search - Function

Biological species

Photorhabdus luminescens subsp. laumondii (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MIRAS / Resolution: 2 Å

Authors

Rosado, C.J. / Buckle, A.M. / Law, R.H.P. / Butcher, R.E. / Kan, W.T. / Bird, C.H. / Ung, K. / Browne, K.A. / Baran, K. / Bashtannyk-Puhalovich, T.A. ...

Citation

Journal: Science / Year: 2007
Title: A common fold mediates vertebrate defense and bacterial attack
Authors: Rosado, C.J. / Buckle, A.M. / Law, R.H. / Butcher, R.E. / Kan, W.T. / Bird, C.H. / Ung, K. / Browne, K.A. / Baran, K. / Bashtannyk-Puhalovich, T.A. / Faux, N.G. / Wong, W. / Porter, C.J. / ...

History

Deposition	Jul 22, 2007	Deposition site: RCSB / Processing site: PDBJ
Revision 1.0	Sep 4, 2007	Provider: repository / Type: Initial release
Revision 1.1	Jul 13, 2011	Group: Advisory / Version format compliance
Revision 1.2	Oct 25, 2017	Group: Refinement description / Category: software
Revision 1.3	Mar 13, 2024	Group: Data collection / Database references / Derived calculations Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_struct_conn_angle / struct_conn / struct_ref_seq_dif / struct_site Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr1_symmetry / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.ptnr3_symmetry / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr1_symmetry / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_label_seq_id / _struct_conn.ptnr2_symmetry / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	2qp2.cif.gz	122.6 KB	Display	PDBx/mmCIF format
PDB format	pdb2qp2.ent.gz	92.5 KB	Display	PDB format
PDBx/mmJSON format	2qp2.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Summary document	2qp2_validation.pdf.gz	424.4 KB	Display	wwPDB validaton report
Full document	2qp2_full_validation.pdf.gz	426.4 KB	Display
Data in XML	2qp2_validation.xml.gz	22.1 KB	Display
Data in CIF	2qp2_validation.cif.gz	33.4 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/qp/2qp2 ftp://data.pdbj.org/pub/pdb/validation_reports/qp/2qp2	HTTPS FTP

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Related structure data

Similar structure data	3hul-d 5vfy-d 2d4y-1 5ius-2 4j8z-2 4j8z-1 6dnr-d 7kwz-d 6dmd-1 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

Deposited unit

A: Unknown protein

hetero molecules

57.2 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)	97.439, 154.507, 43.917
Angle α, β, γ (deg.)	90.000, 90.000, 90.000
Int Tables number	18
Space group name H-M	P2₁2₁2

#1: Protein	Unknown protein Mass: 57164.672 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Photorhabdus luminescens subsp. laumondii (bacteria) Species: Photorhabdus luminescens / Strain: subsp. laumondii / Gene: Photorhabdus luminescens / Plasmid: pDEST / Production host: Escherichia coli (E. coli) / Strain (production host): Rosetta-gami (DE3) pLysS / References: UniProt: Q7N6X0
#2: Chemical	ChemComp-CA / CALCIUM ION Mass: 40.078 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: Ca
#3: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 356 / 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: 2.89 Å³/Da / Density % sol: 57.46 %
Crystal grow	Temperature: 298 K / Method: vapor diffusion, hanging drop / pH: 6 Details: 20% PEG8000, 0.1M MES pH6.0, 0.2M Calcium Acetate, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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Data collection

Diffraction

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

Diffraction source

Source	Site	Beamline	Type	ID	Wavelength (Å)
ROTATING ANODE			ELLIOTT GX-18	1	1.5418
SYNCHROTRON	APS	17-ID		2	1

Detector

Type	ID	Detector	Date
RIGAKU RAXIS IV	1	IMAGE PLATE	Feb 4, 2007
ADSC QUANTUM 4	2	CCD	Apr 10, 2007

Radiation

Monochromator: MIRRORS / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray

Radiation wavelength

ID	Wavelength (Å)	Relative weight
1	1.5418	1
2	1	1

Reflection

Redundancy: 7.5 % / Av σ(I) over netI: 7.2 / Number: 172665 / R_merge(I) obs: 0.088 / R_sym value: 0.088 / Χ²: 1.14 / D res high: 2.457 Å / D res low: 155.012 Å / Num. obs: 23066 / % possible obs: 91

Diffraction reflection shell

ID: 1

Highest resolution (Å)	Lowest resolution (Å)	% possible obs (%)	R_merge(I) obs	R_sym value	Chi squared	Redundancy
7.72	46.37	99.7	0.03	0.03	1.414	7.7
5.46	7.72	100	0.036	0.036	1.339	8.5
4.46	5.46	100	0.049	0.049	1.277	8.6
3.86	4.46	100	0.064	0.064	1.158	8.6
3.45	3.86	100	0.09	0.09	1.103	8.4
3.15	3.45	100	0.133	0.133	1.025	8
2.92	3.15	99.7	0.207	0.207	0.984	7.6
2.73	2.92	98.3	0.312	0.312	0.987	7.5
2.57	2.73	90.8	0.444	0.444	0.988	5.9
2.44	2.57	49.3	0.585	0.585	0.872	4.2

Reflection

Resolution: 2→100 Å / Num. obs: 44074 / % possible obs: 96.9 % / Observed criterion σ(F): 0 / Observed criterion σ(I): 0 / Redundancy: 3.9 % / R_merge(I) obs: 0.047 / Χ²: 1.144 / Net I/σ(I): 15.8

Reflection shell

Resolution: 2→2.07 Å / Redundancy: 2.4 % / R_merge(I) obs: 0.426 / Mean I/σ(I) obs: 2.1 / Num. unique all: 3518 / Χ²: 0.872 / % possible all: 79.1

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Phasing

Phasing

Method:

MIRAS

Phasing set

ID
1
2
3
4

Phasing MIR der

Native set-ID: 1 / Resolution: 2.51→48.67 Å

ID	Der set-ID	Power acentric	Power centric	Reflection acentric	Reflection centric
ISO_1	1	0	0	19288	2902
ISO_2	2	0.602	0.555	7237	1550
ISO_3	3	0.914	0.723	11449	1931
ISO_4	4	0.346	0.359	10176	1684

Phasing MIR der shell

Highest resolution (Å)	Lowest resolution (Å)	Der-ID	Power acentric	Power centric	Reflection acentric	Reflection centric
10.95	48.67	ISO_1	0	0	184	151
7.84	10.95	ISO_1	0	0	385	163
6.43	7.84	ISO_1	0	0	509	158
5.58	6.43	ISO_1	0	0	611	159
5	5.58	ISO_1	0	0	710	161
4.57	5	ISO_1	0	0	794	167
4.23	4.57	ISO_1	0	0	866	160
3.96	4.23	ISO_1	0	0	925	162
3.74	3.96	ISO_1	0	0	1008	156
3.55	3.74	ISO_1	0	0	1066	168
3.38	3.55	ISO_1	0	0	1101	152
3.24	3.38	ISO_1	0	0	1184	161
3.11	3.24	ISO_1	0	0	1224	159
3	3.11	ISO_1	0	0	1272	148
2.9	3	ISO_1	0	0	1291	146
2.81	2.9	ISO_1	0	0	1356	132
2.72	2.81	ISO_1	0	0	1282	124
2.65	2.72	ISO_1	0	0	1298	116
2.58	2.65	ISO_1	0	0	1201	90
2.51	2.58	ISO_1	0	0	1021	69
10.95	48.67	ISO_2	0.953	0.802	183	140
7.84	10.95	ISO_2	1.148	0.966	385	163
6.43	7.84	ISO_2	1.128	0.995	509	158
5.58	6.43	ISO_2	0.975	0.81	611	153
5	5.58	ISO_2	0.78	0.668	710	156
4.57	5	ISO_2	0.514	0.39	788	155
4.23	4.57	ISO_2	0.488	0.353	859	149
3.96	4.23	ISO_2	0.44	0.337	924	149
3.74	3.96	ISO_2	0.38	0.271	1008	145
3.55	3.74	ISO_2	0.35	0.248	1065	156
3.38	3.55	ISO_2	0.379	0.251	195	26
3.24	3.38	ISO_2	0	0	0	0
3.11	3.24	ISO_2	0	0	0	0
3	3.11	ISO_2	0	0	0	0
2.9	3	ISO_2	0	0	0	0
2.81	2.9	ISO_2	0	0	0	0
2.72	2.81	ISO_2	0	0	0	0
2.65	2.72	ISO_2	0	0	0	0
2.58	2.65	ISO_2	0	0	0	0
2.51	2.58	ISO_2	0	0	0	0
10.95	48.67	ISO_3	1.004	0.772	182	137
7.84	10.95	ISO_3	1.547	1.073	384	151
6.43	7.84	ISO_3	1.488	1.276	505	141
5.58	6.43	ISO_3	1.394	1.039	604	145
5	5.58	ISO_3	1.191	0.931	700	142
4.57	5	ISO_3	1.036	0.697	779	147
4.23	4.57	ISO_3	0.95	0.712	847	140
3.96	4.23	ISO_3	0.839	0.593	906	142
3.74	3.96	ISO_3	0.834	0.533	984	135
3.55	3.74	ISO_3	0.742	0.532	1038	146
3.38	3.55	ISO_3	0.75	0.527	1071	127
3.24	3.38	ISO_3	0.733	0.519	1149	135
3.11	3.24	ISO_3	0.712	0.512	1184	134
3	3.11	ISO_3	0.7	0.46	1109	109
2.9	3	ISO_3	0.647	0	7	0
2.81	2.9	ISO_3	0	0	0	0
2.72	2.81	ISO_3	0	0	0	0
2.65	2.72	ISO_3	0	0	0	0
2.58	2.65	ISO_3	0	0	0	0
2.51	2.58	ISO_3	0	0	0	0
10.95	48.67	ISO_4	1.197	1.041	184	140
7.84	10.95	ISO_4	0.978	0.831	384	154
6.43	7.84	ISO_4	0.913	0.672	507	150
5.58	6.43	ISO_4	0.795	0.55	607	149
5	5.58	ISO_4	0.541	0.489	703	148
4.57	5	ISO_4	0.396	0.28	780	152
4.23	4.57	ISO_4	0.293	0.219	844	137
3.96	4.23	ISO_4	0.245	0.22	887	136
3.74	3.96	ISO_4	0.229	0.217	950	120
3.55	3.74	ISO_4	0.214	0.185	943	114
3.38	3.55	ISO_4	0.243	0.208	948	111
3.24	3.38	ISO_4	0.249	0.182	976	106
3.11	3.24	ISO_4	0.255	0.215	918	47
3	3.11	ISO_4	0.298	0.261	545	20
2.9	3	ISO_4	0	0	0	0
2.81	2.9	ISO_4	0	0	0	0
2.72	2.81	ISO_4	0	0	0	0
2.65	2.72	ISO_4	0	0	0	0
2.58	2.65	ISO_4	0	0	0	0
2.51	2.58	ISO_4	0	0	0	0

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Processing

Software

Name	Version	Classification
DENZO		data reduction
SCALEPACK		data scaling
SHARP		phasing
SOLOMON		phasing
REFMAC		refinement
PDB_EXTRACT	3	data extraction
HKL-2000		data collection

Refinement

Method to determine structure:

MIRAS / Resolution: 2→41.21 Å / Cor.coef. F_o:F_c: 0.955 / Cor.coef. F_o:F_c free: 0.947 / SU B: 5.983 / SU ML: 0.087 / TLS residual ADP flag: LIKELY RESIDUAL / Cross valid method: THROUGHOUT / σ(F): 0 / σ(I): 0 / ESU R: 0.154 / ESU R Free: 0.134 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.204	2245	5.1 %	RANDOM
R_work	0.18	-	-	-
obs	0.182	44064	96.67 %	-
all	-	44064	-	-

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: 26.066 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-0.16 Å²	0 Å²	0 Å²
2-	-	0.57 Å²	0 Å²
3-	-	-	-0.41 Å²

Refinement step

Cycle: LAST / Resolution: 2→41.21 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	3815	0	2	356	4173

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.007	0.022	3969
X-RAY DIFFRACTION	r_angle_refined_deg	0.961	1.95	5406
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	4.961	5	525
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	34.393	25.14	179
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	12.923	15	645
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	16.241	15	13
X-RAY DIFFRACTION	r_chiral_restr	0.072	0.2	602
X-RAY DIFFRACTION	r_gen_planes_refined	0.003	0.02	3054
X-RAY DIFFRACTION	r_nbd_refined	0.172	0.2	1735
X-RAY DIFFRACTION	r_nbtor_refined	0.296	0.2	2765
X-RAY DIFFRACTION	r_xyhbond_nbd_refined	0.101	0.2	349
X-RAY DIFFRACTION	r_metal_ion_refined	0.099	0.2	5
X-RAY DIFFRACTION	r_symmetry_vdw_refined	0.156	0.2	25
X-RAY DIFFRACTION	r_symmetry_hbond_refined	0.082	0.2	13
X-RAY DIFFRACTION	r_symmetry_metal_ion_refined	0.075	0.2	1
X-RAY DIFFRACTION	r_mcbond_it	0.582	2	2585
X-RAY DIFFRACTION	r_mcangle_it	1.23	5	4047
X-RAY DIFFRACTION	r_scbond_it	2.444	7	1581
X-RAY DIFFRACTION	r_scangle_it	3.703	10	1345

LS refinement shell

Resolution: 2.004→2.056 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.236	138	-
R_work	0.218	2357	-
all	-	2495	-
obs	-	-	75.58 %

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	7.3881	-3.1137	3.3907	4.8721	-1.9417	7.4403	0.0237	-0.1223	-0.1355	-0.0148	-0.0093	-0.2994	0.1704	0.7748	-0.0144	0.0687	-0.0086	0.0387	0.1664	-0.0228	0.055	70.387	49.733	11.691
2	1.533	0.1791	0.07	3.3796	-0.904	1.2864	-0.0745	0.0606	0.0674	-0.0643	0.0798	0.1108	-0.1206	-0.0634	-0.0053	0.07	0.0118	0.0013	0.1167	-0.0298	0.0279	56.958	52.176	9.646
3	1.4265	0.3877	-0.939	6.791	3.52	9.4229	0.0158	-0.1258	0.4249	0.0041	0.3649	-0.0325	-0.648	-0.0551	-0.3807	0.0613	0.1032	-0.0647	-0.0024	-0.0017	0.1064	52.144	67.992	10.465
4	3.2925	-0.2491	3.3069	1.7614	-2.2257	7.6576	-0.1166	-0.2848	0.2039	0.2058	0.2406	0.234	-0.5652	-0.7751	-0.124	0.0612	0.116	-0.0091	0.0383	-0.088	0.0506	52.59	61.944	19.693
5	1.6911	-0.4106	0.3526	2.5738	1.4664	2.4669	0.0125	-0.151	-0.2414	0.193	0.0125	0.1448	0.1638	-0.113	-0.0249	0.0686	-0.0197	-0.0016	0.1158	0.0141	0.0625	58.737	35.692	29.191
6	4.7455	0.288	3.2943	2.7911	-0.3248	4.269	0.0187	-0.254	-0.3189	0.1013	0.0413	0.1522	0.189	-0.3129	-0.06	0.1309	-0.0109	-0.0001	0.0774	0.002	0.031	56.512	36.948	21.07
7	1.6254	-1.2199	0.4175	8.2337	-0.0622	2.3821	0.0707	-0.0011	-0.1674	0.0278	0.0361	-0.1051	0.2438	0.1285	-0.1068	0.0499	0.0206	-0.02	0.1081	-0.0026	0.0588	67.399	35.453	28.636
8	9.7247	2.4318	9.805	0.8214	3.1216	15.4529	0.0818	-0.3958	-0.1028	0.3614	0.0348	0.1773	-0.0672	-0.5949	-0.1166	0.1309	0.0852	-0.0232	0.0458	-0.047	0.0581	54.6	58.292	21.444
9	2.8226	2.4431	0.9758	9.4289	3.8084	3.3404	-0.2623	0.2186	0.1839	-0.425	0.0341	0.4703	-0.1005	-0.237	0.2283	0.0199	0.006	-0.0549	0.175	0.0069	0.0181	43.895	46.192	1.713
10	0.715	0.0043	0.4936	0.337	0.1656	0.9281	-0.0321	0.1149	-0.0943	-0.0268	0.0347	0.0338	-0.0079	-0.0322	-0.0026	0.064	0.008	0.0078	0.1211	-0.0309	0.0603	57.116	42.219	15.963
11	1.1571	-0.3146	-0.3736	2.0606	1.1	4.4357	0.0204	-0.0802	-0.0901	0.1297	-0.0747	0.1349	0.1384	-0.0455	0.0543	0.0353	0.0329	-0.002	0.1211	-0.0081	0.0452	67.65	40.21	42.107
12	0.6343	-0.4466	0.2235	2.8123	-1.3585	4.5445	-0.0422	0.0253	0.0364	-0.0127	-0.0485	-0.1685	0.0825	0.3139	0.0907	0.0055	0.0161	-0.0106	0.1544	-0.0212	0.1272	73	44.003	34.12
13	2.8963	0.8689	1.8982	1.1627	0.3873	2.8275	-0.0525	-0.2668	0.1298	0.1511	-0.0747	-0.0483	-0.184	-0.0644	0.1273	0.0968	0.0037	0.0045	0.0922	-0.0415	0.0608	64.519	52.715	26.457
14	10.6264	-4.8086	5.1308	2.9608	-1.9038	3.4316	0.0795	-0.1377	-0.3284	0.1082	0.0288	0.1505	0.2457	-0.2155	-0.1084	0.0217	-0.0512	-0.0071	0.1063	0.006	0.0658	45.137	33.533	10.578
15	7.2406	-12.0975	4.8021	20.6755	-8.6072	3.9209	0.1207	0.2322	-0.4028	-0.4176	0.0099	0.462	0.0104	0.0042	-0.1305	0.0889	0.0347	-0.0943	0.0052	-0.0398	0.1378	67.831	13.922	25.019
16	5.7101	-4.1806	1.5427	11.5836	-4.0252	11.3233	-0.0031	0.4866	0.6642	0.3124	-0.3107	-1.4353	-0.4127	0.8328	0.3138	-0.0746	-0.042	-0.0041	-0.0565	0.0393	0.202	82.903	8.642	31.617
17	4.3223	-4.5468	2.6466	8.8	-3.2236	3.2812	0.2488	0.0724	-0.7968	-0.5262	0.0536	0.8899	0.1983	-0.0467	-0.3023	0.0712	0.0089	-0.0517	-0.0195	-0.0572	0.2231	68.57	6.143	28.278
18	7.0495	-5.908	3.0134	9.3728	-3.1209	2.7696	-0.0497	-0.1097	-0.7414	0.3733	0.3242	1.1285	-0.0216	-0.1737	-0.2744	0.0604	0.0172	0.0357	-0.0226	0.0173	0.1977	69.548	3.044	33.74
19	7.5353	-1.9492	5.9088	7.426	2.9372	7.5144	0.4963	-1.0789	-0.1623	2.8369	-0.6277	0.1481	-0.3249	0.5841	0.1314	0.3097	0.0608	0.0255	0.324	0.1107	0.322	68.228	11.312	44.004
20	0.9427	-1.3197	1.9835	8.8896	-2.3304	4.8824	-0.6657	-0.4997	-0.33	1.8876	0.7847	0.3194	-0.4715	-0.3823	-0.119	0.2652	0.154	0.0833	-0.029	0.0113	0.0175	73.178	5.722	43.114

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Label asym-ID	Auth seq-ID	Label seq-ID
1	X-RAY DIFFRACTION	1	A	A	8 - 30	9 - 31
2	X-RAY DIFFRACTION	2	A	A	31 - 69	32 - 70
3	X-RAY DIFFRACTION	3	A	A	70 - 85	71 - 86
4	X-RAY DIFFRACTION	4	A	A	86 - 102	87 - 103
5	X-RAY DIFFRACTION	5	A	A	103 - 120	104 - 121
6	X-RAY DIFFRACTION	6	A	A	121 - 138	122 - 139
7	X-RAY DIFFRACTION	7	A	A	139 - 158	140 - 159
8	X-RAY DIFFRACTION	8	A	A	159 - 165	160 - 166
9	X-RAY DIFFRACTION	9	A	A	166 - 189	167 - 190
10	X-RAY DIFFRACTION	10	A	A	190 - 219	191 - 220
11	X-RAY DIFFRACTION	11	A	A	220 - 250	221 - 251
12	X-RAY DIFFRACTION	12	A	A	251 - 275	252 - 276
13	X-RAY DIFFRACTION	13	A	A	276 - 331	277 - 332
14	X-RAY DIFFRACTION	14	A	A	332 - 354	333 - 355
15	X-RAY DIFFRACTION	15	A	A	355 - 367	356 - 368
16	X-RAY DIFFRACTION	16	A	A	368 - 391	369 - 392
17	X-RAY DIFFRACTION	17	A	A	392 - 428	393 - 429
18	X-RAY DIFFRACTION	18	A	A	429 - 469	430 - 470
19	X-RAY DIFFRACTION	19	A	A	474 - 486	475 - 487
20	X-RAY DIFFRACTION	20	A	A	487 - 509	488 - 510

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