PDB-5u9p: Crystal structure of a gluconate 5-dehydrogenase from Burkholderi...

ID or keywords:

Entry

Database: PDB / ID: 5u9p

Title

Crystal structure of a gluconate 5-dehydrogenase from Burkholderia cenocepacia J2315 in complex with NADP and tartrate

Components

Gluconate 5-dehydrogenase

Keywords

OXIDOREDUCTASE / SSGCID / structural genomics / Burkholderia cenocepacia / gluconate 5-dehydrogenase / dehydrogenase / NAD / tartrate / Seattle Structural Genomics Center for Infectious Disease

Function / homology

Function and homology information

gluconate 5-dehydrogenase / gluconate 5-dehydrogenase activity / nucleotide binding
Similarity search - Function

Biological species

Burkholderia cenocepacia (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 1.65 Å

Authors

Seattle Structural Genomics Center for Infectious Disease (SSGCID)

Citation

Journal: TO BE PUBLISHED
Title: Crystal structure of a gluconate 5-dehydrogenase from Burkholderia cenocepacia J2315 in complex with NADP and tartrate
Authors: Abendroth, J. / Edwards, T.E. / Lorimer, D.D.

History

Deposition	Dec 17, 2016	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Jan 18, 2017	Provider: repository / Type: Initial release
Revision 1.1	Oct 4, 2023	Group: Data collection / Database references / Refinement description Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	5u9p.cif.gz	427.3 KB	Display	PDBx/mmCIF format
PDB format	pdb5u9p.ent.gz	348.4 KB	Display	PDB format
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Validation report

Summary document	5u9p_validation.pdf.gz	1.6 MB	Display	wwPDB validaton report
Full document	5u9p_full_validation.pdf.gz	1.6 MB	Display
Data in XML	5u9p_validation.xml.gz	50.3 KB	Display
Data in CIF	5u9p_validation.cif.gz	75.2 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/u9/5u9p ftp://data.pdbj.org/pub/pdb/validation_reports/u9/5u9p	HTTPS FTP

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Related structure data

Related structure data	4iboS S: Starting model for refinement
Similar structure data	4bgi-1 4bgi-3 5fff-1 4bnn-1 4d41-1 3k2e-1 1ahi-1 6f9q-d 5i7f-2 2wyw-d Search similar-shape structures by Omokage search (details) Similarity search - Function & homologyF&H Search Similarity search - FunctionF&H Search Similarity search - HomologyF&H Search
Other databases	TargetTrack: SSGCID-BuceA.00010.x

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#188 - Aug 2015 Tetrahydrobiopterin Biosynthesis similarity (3) #216 - Dec 2017 Biodegradable Plastic similarity (3) #90 - Jun 2007 Fatty Acid Synthase similarity (3) #77 - May 2006 Glucose Oxidase similarity (3) #228 - Dec 2018 Directed Evolution of Enzymes similarity (1)

Deposited unit

A: Gluconate 5-dehydrogenase

B: Gluconate 5-dehydrogenase

C: Gluconate 5-dehydrogenase

D: Gluconate 5-dehydrogenase

hetero molecules

120 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

Idetical with deposited unit
defined by author&software

Unit cell

Length a, b, c (Å)	87.380, 91.680, 121.440
Angle α, β, γ (deg.)	90.000, 90.000, 90.000
Int Tables number	19
Space group name H-M	P2₁2₁2₁

#1: Protein	Gluconate 5-dehydrogenase Mass: 28684.502 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Burkholderia cenocepacia (strain ATCC BAA-245 / DSM 16553 / LMG 16656 / NCTC 13227 / J2315 / CF5610) (bacteria) Strain: ATCC BAA-245 / DSM 16553 / LMG 16656 / NCTC 13227 / J2315 / CF5610 Gene: idnO, BCAL3386 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: B4EEX4, gluconate 5-dehydrogenase
#2: Chemical	ChemComp-NAP / NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE / 2'-MONOPHOSPHOADENOSINE 5'-DIPHOSPHORIBOSE Mass: 743.405 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C₂₁H₂₈N₇O₁₇P₃
#3: Chemical	ChemComp-TLA / L(+)-TARTARIC ACID Mass: 150.087 Da / Num. of mol.: 8 / Source method: obtained synthetically / Formula: C₄H₆O₆
#4: Chemical	ChemComp-EDO / 1,2-ETHANEDIOL / ETHYLENE GLYCOL Mass: 62.068 Da / Num. of mol.: 10 / Source method: obtained synthetically / Formula: C₂H₆O₂
#5: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 1137 / 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: 2.12 Å³/Da / Density % sol: 42.09 %
Crystal grow	Temperature: 290 K / Method: vapor diffusion, sitting drop / pH: 7.5 Details: Microlytic MCSG1 screen, E10: 20% (w/V) PEG 3350, 200mM Ammonium tartrate: BuceA.00010.x.B1.PW37241 at 20.44mg/ml + 4mM NADP: cryo: 20% EG + 10mM NADP in 2 steps: tray 285582 e10, puck bdg3-9

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Data collection

Diffraction

Mean temperature: 100 K

Diffraction source

Source:

SYNCHROTRON / Site:

APS

/ Beamline: 21-ID-G / Wavelength: 0.97856 Å

Detector

Type: RAYONIX MX-300 / Detector: CCD / Date: Nov 29, 2016

Radiation

Monochromator: Diamond [111] / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray

Radiation wavelength

Wavelength: 0.97856 Å / Relative weight: 1

Reflection

Resolution: 1.65→50 Å / Num. obs: 116982 / % possible obs: 99.3 % / Observed criterion σ(I): -3 / Redundancy: 5.14 % / B_iso Wilson estimate: 12.86 Å² / CC_1/2: 0.999 / R_merge(I) obs: 0.073 / Net I/σ(I): 17.93

Reflection shell

Resolution (Å)	Redundancy (%)	R_merge(I) obs	Mean I/σ(I) obs	CC_1/2	Diffraction-ID	% possible all
1.65-1.69	3.68	0.58	2.14	0.713	1	92.4
1.69-1.74	4.33	0.486	2.96	0.829	1	99.4
1.74-1.79	4.8	0.42	3.69	0.882	1	99.9
1.79-1.84	5.38	0.326	5.21	0.94	1	100
1.84-1.91	5.4	0.253	6.68	0.962	1	100
1.91-1.97	5.39	0.206	8.18	0.972	1	99.9
1.97-2.05	5.39	0.158	10.58	0.986	1	99.9
2.05-2.13	5.41	0.132	12.7	0.989	1	100
2.13-2.22	5.41	0.104	15.7	0.993	1	100
2.22-2.33	5.13	0.091	17.63	0.994	1	100
2.33-2.46	5.39	0.079	19.89	0.995	1	100
2.46-2.61	5.42	0.065	23.51	0.997	1	100
2.61-2.79	5.41	0.057	26.49	0.998	1	99.9
2.79-3.01	5.41	0.046	31.99	0.998	1	100
3.01-3.3	5.38	0.037	37.81	0.999	1	99.9
3.3-3.69	5.36	0.03	45.2	0.999	1	99.9
3.69-4.26	5.34	0.027	49.38	0.999	1	99.9
2.46-5.22	5.28	0.023	53.99	0.999	1	99.9
5.22-7.38	5.16	0.026	48.11	0.999	1	99.9
7.38-50	4.67	0.022	53.73	0.999	1	96.5

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Processing

Software

Name	Classification
XDS	data reduction
XSCALE	data scaling
MoRDa	phasing
XDS	data reduction
Coot	model building
PHENIX	refinement
PDB_EXTRACT	data extraction

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 4ibo

4ibo

Resolution: 1.65→50 Å / SU ML: 0.16 / Cross valid method: FREE R-VALUE / σ(F): 1.35 / Phase error: 14.83

	R_factor	Num. reflection	% reflection
R_free	0.1639	1965	1.68 %
R_work	0.1355	-	-
obs	0.136	116823	99.32 %

Solvent computation

Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å

Displacement parameters

B_iso max: 70.25 Å² / B_iso mean: 14.9941 Å² / B_iso min: 4.72 Å²

Refinement step

Cycle: final / Resolution: 1.65→50 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	7763	0	312	1160	9235
B_iso mean	-	-	15.2	27.75	-
Num. residues	-	-	-	-	1031

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.009	8355
X-RAY DIFFRACTION	f_angle_d	0.971	11372
X-RAY DIFFRACTION	f_chiral_restr	0.065	1262
X-RAY DIFFRACTION	f_plane_restr	0.006	1588
X-RAY DIFFRACTION	f_dihedral_angle_d	13.05	5001

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / R_factor R_free error: 0 / Total num. of bins used: 14

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Num. reflection all	% reflection obs (%)
1.65-1.6913	0.2345	122	0.2328	7562	7684	92
1.6913-1.737	0.2317	159	0.1944	8083	8242	99
1.737-1.7881	0.2318	162	0.1764	8155	8317	100
1.7881-1.8458	0.1818	150	0.1527	8150	8300	100
1.8458-1.9118	0.1875	159	0.1443	8174	8333	100
1.9118-1.9883	0.1924	114	0.1526	8213	8327	100
1.9883-2.0788	0.1625	119	0.1307	8232	8351	100
2.0788-2.1884	0.161	151	0.1248	8212	8363	100
2.1884-2.3255	0.1398	131	0.1234	8216	8347	100
2.3255-2.5051	0.1644	143	0.1271	8268	8411	100
2.5051-2.7571	0.1428	157	0.1272	8271	8428	100
2.7571-3.1559	0.1528	120	0.1266	8312	8432	100
3.1559-3.9756	0.1414	155	0.1199	8382	8537	100
3.9756-41.1232	0.1568	123	0.1289	8628	8751	99

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	2.1213	1.8771	-0.1991	3.3154	-1.0304	0.7877	-0.3434	0.138	0.7787	-0.3162	-0.0575	0.0292	-0.5691	0.1948	0.1405	0.204	-0.0187	-0.057	0.1469	0.0329	0.2705	-40.5006	15.9568	9.9179
2	1.6283	0.1416	0.5868	3.7958	-0.6618	2.2156	-0.0016	-0.2281	0.0705	0.1359	0.0015	0.1486	-0.0366	-0.0534	0.0606	0.0418	-0.0014	0.0133	0.0888	-0.0122	0.0964	-46.1249	0.5877	19.0807
3	2.4736	-0.8128	-0.466	1.6564	-0.1241	0.9821	0.0149	-0.17	-0.0999	0.0741	-0.0118	0.285	-0.0125	-0.1052	0.0019	0.0668	-0.0031	-0.0059	0.1133	-0.0016	0.0978	-53.8828	-2.5036	18.043
4	0.9353	-0.4086	0.4899	0.9627	-0.5407	1.1209	0.043	-0.0571	-0.1263	-0.0741	0.0314	0.2295	0.0848	-0.1278	-0.0756	0.0626	-0.0179	-0.0106	0.0824	-0.0004	0.1081	-44.1724	-11.7299	13.7446
5	1.4589	-1.1981	1.5046	1.86	-1.6907	2.9054	0.0897	0.0052	-0.1612	-0.1044	-0.0113	0.1978	0.1645	0.0119	-0.1029	0.0713	-0.0039	-0.0024	0.0667	-0.0109	0.1047	-40.2648	-14.3798	10.8625
6	0.6513	-0.1853	0.2847	0.7467	-0.0845	0.4291	-0.0238	-0.1076	0.0044	0.0699	0.0122	0.0214	-0.016	-0.0172	0.0118	0.0579	-0.0052	0.0054	0.0734	-0.0041	0.0543	-31.0676	-3.3954	20.4472
7	2.0623	0.2723	1.2577	0.3867	0.6494	1.4538	0.1072	-0.1036	-0.3092	0.0883	-0.2354	-0.8205	-0.0596	0.6415	0.0634	0.1978	0.0139	-0.0507	0.3023	0.0629	0.3772	6.392	-29.2082	20.6105
8	2.9572	-0.6079	1.0772	1.2522	-0.4229	2.0867	0.1135	0.1703	-0.1368	-0.1847	-0.0692	-0.0414	0.1617	0.097	-0.0388	0.1044	0.016	-0.0011	0.0537	-0.0076	0.1034	-12.7493	-34.1033	8.7272
9	4.7986	-1.5438	0.533	0.8482	-0.0468	1.126	0.008	0.2222	-0.286	-0.1337	-0.0838	0.2854	0.1698	-0.0073	0.0498	0.1378	-0.0029	-0.0115	0.053	0.0073	0.1257	-15.6381	-42.8153	7.8513
10	5.2531	-2.3006	-0.449	1.4341	0.1858	0.7769	-0.1011	-0.0539	-0.2828	-0.0166	0.047	0.1849	0.095	0.0017	0.069	0.111	-0.0093	-0.0049	0.0764	0.0091	0.1269	-18.9737	-40.1406	11.8536
11	1.2061	-0.5946	0.596	1.443	-0.4903	1.1559	0.0268	-0.0432	-0.1718	-0.0675	-0.0088	0.0789	0.1346	-0.0292	-0.0605	0.0841	-0.008	0	0.0528	-0.0127	0.0904	-25.6205	-31.1926	12.5899
12	0.9018	-0.5182	0.4841	1.0986	-0.5553	1.3509	-0.0049	-0.0454	-0.0508	-0.0016	0.0055	0.0353	0.0309	-0.0046	-0.001	0.0587	-0.0001	0.0114	0.0474	-0.006	0.0645	-23.9505	-22.585	15.8751
13	1.3308	-0.0441	0.3707	1.0473	-0.0246	1.5371	0.1785	0.3251	-0.1455	-0.3246	0.0315	0.1194	0.3824	0.1148	-0.1436	0.1688	0.0224	-0.0391	0.1102	-0.0331	0.1183	-16.3845	-22.0044	2.5718
14	3.9349	0.8827	1.4072	2.7051	1.7407	2.4441	-0.1592	0.438	0.1115	-0.5472	0.0224	0.1717	-0.1389	0.1475	0.1223	0.1764	0.0059	-0.0036	0.1577	-0.0126	0.0887	-12.55	-13.1965	-6.2625
15	0.4048	-0.1867	0.1056	0.4611	-0.604	1.2177	-0.0093	0.0199	-0.0351	-0.0047	-0.0117	-0.0512	0.0512	0.0225	0.0162	0.0815	-0.0014	-0.0062	0.0934	-0.014	0.1056	-9.0844	-18.8132	12.3943
16	2.028	1.157	0.2815	2.953	0.736	1.3735	-0.069	0.1409	-0.3523	-0.1407	0.0806	-0.1253	0.1612	0.0701	0.0196	0.076	0.0256	0.0147	0.0937	-0.0151	0.1328	8.6517	-18.9608	13.2462
17	1.9696	1.1351	0.1556	3.021	0.7202	1.1639	0.0103	-0.1178	-0.1256	0.0825	-0.0266	-0.1159	0.0702	0.0327	0.0131	0.0488	0.0072	-0.0001	0.0848	0.0075	0.0773	12.0006	-12.0459	20.9205
18	1.4218	-1.1479	0.5406	4.6792	-1.2372	0.9324	0.0139	-0.0559	-0.0016	-0.0351	-0.0669	-0.1042	0.0533	0.0841	0.0608	0.0609	-0.0057	0.0135	0.1079	0.0182	0.0772	19.6606	-9.0421	21.3651
19	1.6222	-0.5768	-0.6209	0.8636	0.4766	1.1347	0.0052	-0.0232	0.0741	-0.0069	0.0088	-0.0948	-0.0491	0.1239	-0.0318	0.0548	-0.0094	-0.0126	0.0741	0.003	0.0618	8.5504	0.7616	17.1585
20	1.6832	-0.9797	-1.35	1.5489	1.3182	2.4666	0.0535	0.0053	0.1544	-0.0188	-0.0203	-0.098	-0.11	0.0355	-0.1199	0.062	-0.0034	-0.0091	0.0711	0.013	0.0776	5.3218	3.5301	13.6135
21	1.0333	-0.5377	-0.7581	0.8683	0.6474	1.5277	-0.0178	0.0544	-0.0106	-0.005	-0.0242	0.0107	0.0124	-0.0802	0.0914	0.0536	-0.0111	-0.0047	0.064	-0.009	0.0684	-4.1414	-2.747	14.5229
22	1.4883	0.1796	-0.5171	1.3966	0.2579	2.7784	0.0327	-0.272	0.0106	0.2455	0.0079	-0.0845	0.0614	0.114	-0.0358	0.0703	0.0128	-0.0162	0.0922	0.0028	0.0875	-0.6428	-7.5899	27.9623
23	1.6261	0.058	0.2312	1.3445	0.401	1.5392	0.0105	-0.4262	0.0508	0.2188	-0.0179	0.0328	0.0776	0.014	0.0232	0.1272	-0.0099	0.0051	0.1532	0.0003	0.0776	-9.5022	-11.9269	35.9196
24	1.293	-0.0845	-0.4688	0.591	0.1707	1.3847	-0.0161	0.0282	-0.1046	-0.0247	-0.0064	-0.0135	0.0189	0.0126	0.0155	0.0562	-0.0092	-0.0061	0.0439	-0.0078	0.067	-4.9584	-14.8578	17.1893
25	3.3228	1.8589	1.0678	2.0579	0.8576	2.1759	-0.0717	-0.421	0.3831	0.1913	-0.3482	0.9268	0.1013	-0.6281	0.2826	0.1764	0.0075	0.0408	0.2035	-0.073	0.2503	-36.8909	18.5935	21.2442
26	3.6212	0.2803	-1.3483	2.0902	0.5683	2.7471	-0	0.1577	0.1525	-0.212	0.0246	0.0488	-0.1193	-0.0687	-0.016	0.0983	0.0058	-0.0154	0.0402	0.0083	0.0766	-22.2522	23.3802	11.363
27	1.7434	-0.2847	-0.8153	1.6806	-0.3223	0.8767	0.0129	0.0929	0.3651	-0.1232	0.0426	-0.0527	-0.1935	-0.0728	-0.0532	0.1384	0.0086	-0.0071	0.0727	-0.0103	0.1431	-18.1804	31.1429	12.8179
28	6.8901	-4.0454	-2.4742	4.1141	2.9305	2.1719	0.0257	-0.0616	0.3205	-0.0235	0.0326	-0.1907	-0.1568	0.0369	-0.0608	0.1369	-0.0238	-0.007	0.0691	-0.0098	0.126	-11.152	28.5126	25.4713
29	1.3203	-1.2099	-1.1743	1.9431	1.2318	1.7692	0.049	0.0066	0.057	-0.1206	-0.0452	-0.0836	-0.0801	0.0276	-0.0217	0.0709	-0.0154	0.0002	0.0719	-0	0.0693	-9.1193	14.9661	10.4382
30	4.2123	-2.512	-4.5585	1.621	3.0262	6.0094	0.0012	-0.1693	0.1336	-0.0263	0.0974	-0.1169	-0.0419	0.1954	-0.1313	0.0814	-0.0047	-0.0109	0.0542	-0.002	0.0945	-7.6564	16.5002	19.7451
31	1.048	-0.4389	-0.5677	0.6051	0.2951	0.7287	-0.0392	-0.0079	0.0113	0.0141	-0.0105	0.0256	0.0322	-0.0235	0.0551	0.0811	-0.0081	-0.0031	0.0621	-0.0133	0.0756	-14.2331	7.5895	17.1582
32	1.1354	-0.1387	-0.5566	1.0906	0.4612	1.9415	0.0284	0.1924	0.13	-0.248	-0.0317	-0.0399	-0.2279	-0.0501	-0.0207	0.115	0.0029	-0.0027	0.0764	0.0152	0.0931	-17.5918	12.2618	4.4956
33	1.8397	0.0126	-0.6102	1.1449	0.0698	1.8069	0.0546	0.1576	-0.0007	-0.2544	-0.0764	-0.0424	-0.094	-0.0057	0.0612	0.1589	0.0086	-0.0003	0.1285	-0.0034	0.0699	-21.0511	4.4623	-5.5121
34	0.6386	-0.2038	-0.1703	0.5046	0.2715	1.1042	-0.0028	-0.0108	0.0377	0.0058	-0.0438	0.033	-0.0315	-0.0015	0.049	0.0836	-0.0121	-0.0012	0.0846	-0.0045	0.0853	-26.0051	7.8991	13.2174

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 0 through 13 )	A	0 - 13
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 14 through 34 )	A	14 - 34
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 35 through 72 )	A	35 - 72
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 73 through 109 )	A	73 - 109
5	X-RAY DIFFRACTION	5	chain 'A' and (resid 110 through 138 )	A	110 - 138
6	X-RAY DIFFRACTION	6	chain 'A' and (resid 139 through 257 )	A	139 - 257
7	X-RAY DIFFRACTION	7	chain 'B' and (resid -3 through 13 )	B	-3 - 13
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 14 through 34 )	B	14 - 34
9	X-RAY DIFFRACTION	9	chain 'B' and (resid 35 through 58 )	B	35 - 58
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 59 through 72 )	B	59 - 72
11	X-RAY DIFFRACTION	11	chain 'B' and (resid 73 through 109 )	B	73 - 109
12	X-RAY DIFFRACTION	12	chain 'B' and (resid 110 through 182 )	B	110 - 182
13	X-RAY DIFFRACTION	13	chain 'B' and (resid 183 through 205 )	B	183 - 205
14	X-RAY DIFFRACTION	14	chain 'B' and (resid 206 through 223 )	B	206 - 223
15	X-RAY DIFFRACTION	15	chain 'B' and (resid 224 through 257 )	B	224 - 257
16	X-RAY DIFFRACTION	16	chain 'C' and (resid 3 through 22 )	C	3 - 22
17	X-RAY DIFFRACTION	17	chain 'C' and (resid 23 through 45 )	C	23 - 45
18	X-RAY DIFFRACTION	18	chain 'C' and (resid 46 through 72 )	C	46 - 72
19	X-RAY DIFFRACTION	19	chain 'C' and (resid 73 through 109 )	C	73 - 109
20	X-RAY DIFFRACTION	20	chain 'C' and (resid 110 through 138 )	C	110 - 138
21	X-RAY DIFFRACTION	21	chain 'C' and (resid 139 through 182 )	C	139 - 182
22	X-RAY DIFFRACTION	22	chain 'C' and (resid 183 through 205 )	C	183 - 205
23	X-RAY DIFFRACTION	23	chain 'C' and (resid 206 through 223 )	C	206 - 223
24	X-RAY DIFFRACTION	24	chain 'C' and (resid 224 through 257 )	C	224 - 257
25	X-RAY DIFFRACTION	25	chain 'D' and (resid 1 through 13 )	D	1 - 13
26	X-RAY DIFFRACTION	26	chain 'D' and (resid 14 through 34 )	D	14 - 34
27	X-RAY DIFFRACTION	27	chain 'D' and (resid 35 through 72 )	D	35 - 72
28	X-RAY DIFFRACTION	28	chain 'D' and (resid 73 through 86 )	D	73 - 86
29	X-RAY DIFFRACTION	29	chain 'D' and (resid 87 through 109 )	D	87 - 109
30	X-RAY DIFFRACTION	30	chain 'D' and (resid 110 through 138 )	D	110 - 138
31	X-RAY DIFFRACTION	31	chain 'D' and (resid 139 through 182 )	D	139 - 182
32	X-RAY DIFFRACTION	32	chain 'D' and (resid 183 through 205 )	D	183 - 205
33	X-RAY DIFFRACTION	33	chain 'D' and (resid 206 through 223 )	D	206 - 223
34	X-RAY DIFFRACTION	34	chain 'D' and (resid 224 through 257 )	D	224 - 257

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