PDB-6qa2: R80A MUTANT OF NUCLEOSIDE DIPHOSPHATE KINASE FROM MYCOBACTERIUM T...

ID or keywords:

Entry

Database: PDB / ID: 6qa2

Title

R80A MUTANT OF NUCLEOSIDE DIPHOSPHATE KINASE FROM MYCOBACTERIUM TUBERCULOSIS

Components

Nucleoside diphosphate kinase

Keywords

TRANSFERASE / Remodeling / Open and closed binding site

Function / homology

Function and homology information

nucleoside-diphosphate kinase / UTP biosynthetic process / CTP biosynthetic process / nucleoside diphosphate kinase activity / GTP biosynthetic process / ATP binding / metal ion binding / cytoplasm
Similarity search - Function

Biological species

Mycobacterium tuberculosis (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.2 Å

Authors

Dautant, A. / Henri, J. / Wales, T.E. / Meyer, P. / Engen, J.R. / Georgescauld, F.

Funding support

France, 3items

Citation

Journal: Biochemistry / Year: 2019
Title: Remodeling of the Binding Site of Nucleoside Diphosphate Kinase Revealed by X-ray Structure and H/D Exchange.
Authors: Dautant, A. / Henri, J. / Wales, T.E. / Meyer, P. / Engen, J.R. / Georgescauld, F.

History

Deposition	Dec 18, 2018	Deposition site: PDBE / Processing site: PDBE
Revision 1.0	Feb 27, 2019	Provider: repository / Type: Initial release
Revision 1.1	Mar 20, 2019	Group: Data collection / Database references / Category: citation / pdbx_database_proc Item: _citation.journal_id_ISSN / _citation.journal_volume ..._citation.journal_id_ISSN / _citation.journal_volume / _citation.page_first / _citation.page_last / _citation.title
Revision 1.2	Jan 24, 2024	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	6qa2.cif.gz	309.8 KB	Display	PDBx/mmCIF format
PDB format	pdb6qa2.ent.gz	255.8 KB	Display	PDB format
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Validation report

Summary document	6qa2_validation.pdf.gz	489 KB	Display	wwPDB validaton report
Full document	6qa2_full_validation.pdf.gz	493.7 KB	Display
Data in XML	6qa2_validation.xml.gz	33.3 KB	Display
Data in CIF	6qa2_validation.cif.gz	46.9 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/qa/6qa2 ftp://data.pdbj.org/pub/pdb/validation_reports/qa/6qa2	HTTPS FTP

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Related structure data

Related structure data	4aneS S: Starting model for refinement
Similar structure data	4ane-d 4anc-1 4and-1 5dem-1 3g2x-1 3ddi-1 3fbe-2 5dep-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: Nucleoside diphosphate kinase

B: Nucleoside diphosphate kinase

C: Nucleoside diphosphate kinase

D: Nucleoside diphosphate kinase

E: Nucleoside diphosphate kinase

F: Nucleoside diphosphate kinase

hetero molecules

88.1 kDa, 6 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

Idetical with deposited unit
defined by author&software
Evidence: gel filtration, mass spectrometry

Unit cell

Length a, b, c (Å)	113.107, 121.730, 150.708
Angle α, β, γ (deg.)	90.00, 90.00, 90.00
Int Tables number	23
Space group name H-M	I222

Components on special symmetry positions

ID	Model	Components
1	1	E-305- HOH
2	1	E-347- HOH

#1: Protein	Nucleoside diphosphate kinase / NDP kinase / Nucleoside-2-P kinase Mass: 14436.353 Da / Num. of mol.: 6 / Mutation: R80A Source method: isolated from a genetically manipulated source Source: (gene. exp.) Mycobacterium tuberculosis (strain ATCC 25177 / H37Ra) (bacteria) Strain: ATCC 25177 / H37Ra / Gene: ndk, MRA_2471 / Plasmid: pET24 / Production host: Escherichia coli BL21(DE3) (bacteria) / Variant (production host): RIL / References: UniProt: A5U5E1, nucleoside-diphosphate kinase
#2: Chemical	ChemComp-SO4 / SULFATE ION Mass: 96.063 Da / Num. of mol.: 12 Source method: isolated from a genetically manipulated source Formula: SO₄
#3: Chemical	ChemComp-TAM / TRIS(HYDROXYETHYL)AMINOMETHANE Mass: 163.215 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Formula: C₇H₁₇NO₃ / Comment: pH buffer*YM
#4: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 467 / 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: 2.99 Å³/Da / Density % sol: 58.84 % / Description: Platelets
Crystal grow	Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 7 / Details: 0.8 M ammonium sulfate, 0.1 M HEPES-NaOH, pH 7.0

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Data collection

Diffraction	Mean temperature: 100 K / Serial crystal experiment: N
Diffraction source	Source: SYNCHROTRON / Site: ESRF / Beamline: MASSIF-3 / Wavelength: 0.961 Å
Detector	Type: DECTRIS EIGER X 4M / Detector: PIXEL / Date: Feb 23, 2018 / Details: NULL
Radiation	Monochromator: SI (111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.961 Å / Relative weight: 1
Reflection	Resolution: 2.2→34.3 Å / Num. obs: 52205 / % possible obs: 98.1 % / Redundancy: 7.4 % / B_iso Wilson estimate: 25.65 Å² / R_merge(I) obs: 0.142 / R_pim(I) all: 0.054 / R_rim(I) all: 0.152 / Net I/σ(I): 10.4
Reflection shell	Resolution: 2.2→2.32 Å / Redundancy: 7.6 % / R_merge(I) obs: 0.787 / Mean I/σ(I) obs: 3.1 / Num. unique obs: 7546 / R_pim(I) all: 0.299 / R_rim(I) all: 0.843 / % possible all: 98.3

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Processing

Software

Name	Version	Classification
PHENIX	(1.13_2998: ???)	refinement
iMOSFLM	v7.2.1	data reduction
SCALA	v3.3.22	data scaling
MOLREP	v11.6.04	phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 4ANE

4ane

Resolution: 2.2→34.067 Å / SU ML: 0.24 / Cross valid method: THROUGHOUT / σ(F): 1.34 / Phase error: 22.86

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.214	2475	4.74 %	RANDOM
R_work	0.186	-	-	-
obs	0.186	52182	98.47 %	-

Solvent computation

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

Displacement parameters

B_iso mean: 27 Å²

Refinement step

Cycle: LAST / Resolution: 2.2→34.067 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	5717	0	82	467	6266

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.002	5871
X-RAY DIFFRACTION	f_angle_d	0.49	7975
X-RAY DIFFRACTION	f_dihedral_angle_d	14.465	3488
X-RAY DIFFRACTION	f_chiral_restr	0.043	942
X-RAY DIFFRACTION	f_plane_restr	0.003	1033

LS refinement shell

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Refine-ID	% reflection obs (%)
2.2-2.2423	0.3273	117	0.291	2766	X-RAY DIFFRACTION	99
2.2423-2.2881	0.3842	119	0.3275	2728	X-RAY DIFFRACTION	99
2.2881-2.3378	0.2916	116	0.2313	2773	X-RAY DIFFRACTION	99
2.3378-2.3922	0.2442	127	0.2077	2759	X-RAY DIFFRACTION	99
2.3922-2.452	0.2731	128	0.2072	2741	X-RAY DIFFRACTION	99
2.452-2.5183	0.2189	151	0.1946	2719	X-RAY DIFFRACTION	99
2.5183-2.5923	0.24	130	0.1927	2719	X-RAY DIFFRACTION	98
2.5923-2.676	0.2232	118	0.1881	2728	X-RAY DIFFRACTION	97
2.676-2.7716	0.2253	133	0.1956	2635	X-RAY DIFFRACTION	95
2.7716-2.8825	0.2424	123	0.1957	2576	X-RAY DIFFRACTION	93
2.8825-3.0136	0.2596	138	0.1949	2741	X-RAY DIFFRACTION	98
3.0136-3.1724	0.2121	133	0.1869	2795	X-RAY DIFFRACTION	100
3.1724-3.371	0.219	172	0.1758	2778	X-RAY DIFFRACTION	100
3.371-3.631	0.1927	143	0.1615	2813	X-RAY DIFFRACTION	100
3.631-3.9959	0.166	148	0.1494	2816	X-RAY DIFFRACTION	100
3.9959-4.5729	0.1642	157	0.1298	2805	X-RAY DIFFRACTION	100
4.5729-5.7569	0.1528	170	0.1403	2838	X-RAY DIFFRACTION	100
5.7569-34.0713	0.2108	152	0.1886	2977	X-RAY DIFFRACTION	100

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	7.4351	2.2204	0.3131	6.4285	3.4319	6.1491	0.0632	-0.0911	-0.4213	-0.0502	-0.0703	0.6155	0.3722	-0.8151	-0.0802	0.1928	-0.0226	-0.0283	0.2092	0.0649	0.3946	5.0303	28.614	29.8254
2	9.2164	5.2273	-3.9929	3.4014	-3.3004	5.6068	0.0088	-0.5594	-0.4783	0.7443	-0.3066	-0.8739	0.082	0.615	0.2905	0.2853	-0.0127	-0.0295	0.2692	0.1049	0.35	20.2193	29.8353	40.2757
3	3.6733	-2.7771	1.1638	2.7285	0.8514	6.8682	0.1106	0.3347	0.2625	-0.1025	-0.1016	0.0042	-0.1779	0.1032	-0.0377	0.1852	-0.0437	-0.006	0.2172	0.0699	0.2379	10.5412	35.9352	32.9141
4	6.6551	2.7284	0.3426	5.7681	1.8968	7.1657	0.4038	-0.5668	-0.8183	0.5868	-0.5235	0.8187	0.781	-0.6856	0.0784	0.2619	-0.0821	0.0035	0.3154	0.0768	0.5085	6.6776	17.5667	43.0481
5	4.2791	-5.7525	-0.8405	9.464	3.4919	4.1943	0.0333	-0.1499	-0.1696	-0.6507	-0.2932	-1.066	0.0718	-0.0416	0.2714	0.3018	0.0046	0.0384	0.3642	0.1132	0.7024	12.5674	9.7875	34.7738
6	2.2518	0.8703	-0.7856	3.391	-1.9767	6.4635	0.0096	0.0454	-0.203	-0.0274	0.0333	0.1006	0.2028	0.0555	-0.041	0.1208	-0.0589	0.0093	0.1992	0.0166	0.23	11.4798	24.6813	33.6195
7	7.3169	2.1699	-4.2471	6.9616	-0.9799	8.4586	-0.1319	0.2964	-0.508	-0.1003	0.0505	-0.149	0.3681	-0.0677	0.0488	0.1567	-0.0211	-0.0217	0.2004	0.0295	0.2237	24.176	25.2904	28.443
8	5.1327	2.2756	5.0144	1.1749	2.3408	4.9823	0.9668	-0.7607	-1.5953	0.2537	-0.5976	-0.7744	0.818	-0.834	-0.419	0.2676	-0.0988	-0.0015	0.3158	-0.0119	0.3705	12.8324	23.4984	30.0149
9	9.1615	1.5846	-2.0408	5.4561	2.2429	9.2778	-0.3896	0.1635	-0.6656	-0.2025	-0.1865	0.3341	0.5983	-0.5538	0.5311	0.2146	-0.0586	-0	0.2834	0.0598	0.4072	0.5985	22.4559	33.3664
10	5.9327	2.7735	1.0685	6.3707	0.888	3.1887	0.1677	-0.8035	-0.4774	0.7477	0.0932	0.4699	0.5387	-0.6083	-0.2151	0.3092	0.0114	0.1461	0.3217	0.0535	0.2345	11.6286	43.7314	50.9461
11	3.7473	-4.5428	-5.4721	8.4762	4.5774	9.4152	0.125	0.6974	-0.082	-0.9162	-0.5413	1.4436	-0.5505	-0.8414	0.4328	0.2941	0.0581	-0.0589	0.3395	0.0156	0.5007	5.2216	47.8172	33.8738
12	1.7021	0.5837	1.9066	4.0817	-0.8345	5.5941	0.0855	0.1328	0.161	0.0835	-0.1478	0.0167	-0.0191	0.127	0.0866	0.1647	0.0012	0.0209	0.1604	-0.0038	0.195	12.6009	41.4031	41.863
13	5.2807	-3.846	-0.1802	4.9006	-0.983	4.0526	-0.1889	-0.7858	1.116	0.5428	0.0898	1.3194	-0.7015	-2.075	0.2128	0.4569	0.1216	0.214	0.7607	-0.0294	0.996	-5.0689	49.9416	48.567
14	5.9322	5.7966	5.2789	5.6638	5.1109	7.966	0.1925	-0.1345	-0.2593	0.1779	-0.0111	-0.0347	0.5028	-0.5134	-0.2048	0.1429	-0.0633	0.0895	0.2638	-0.0036	0.1994	7.3809	41.4769	45.3857
15	3.9266	-1.5595	3.9394	6.2734	-5.8558	8.4631	0.1346	0.0149	0.345	0.3011	-0.0394	0.3336	-0.1955	0.0691	-0.1133	0.1901	-0.017	0.0753	0.2492	0.0065	0.3043	15.5375	55.0436	43.2111
16	9.9026	-3.5212	3.6582	2.9288	-0.8008	5.0193	-0.1677	0.4666	0.6387	-0.2399	-0.17	1.3525	-0.7871	-1.3515	0.2577	0.3084	0.0968	-0.0234	0.438	0.0243	0.6237	4.7046	58.8248	36.239
17	6.5	-3.1615	4.6692	4.3494	-3.8477	4.7539	-0.2061	-0.4771	0.7202	0.6381	-0.0292	0.4287	-0.488	-1.4046	0.237	0.2856	-0.0302	0.107	0.3173	-0.0804	0.3881	8.5932	51.7256	47.2886
18	8.309	6.4811	3.1009	7.0127	0.0981	4.4998	0.3333	-1.0886	0.5362	0.9854	-0.3191	0.7902	-0.0265	-0.8247	0.0439	0.3519	-0.0281	0.1834	0.6149	0.0479	0.4576	4.5978	42.7488	55.4763
19	6.5885	-1.1252	0.782	4.3898	-0.1876	5.0575	-0.0107	0.5315	0.2889	-0.1818	0.0315	-0.4178	-0.0421	0.1443	-0.0095	0.1222	0.0021	0.0154	0.3045	0.0486	0.2188	41.6599	37.6552	24.5974
20	2.9701	2.0529	-1.7598	2.4399	0.0752	3.371	0.1038	-0.0441	0.0686	-0.0991	-0.092	-0.2767	0.1226	0.3222	-0.0253	0.2065	0.0606	-0.0126	0.2807	0.0974	0.3312	43.4758	36.6918	27.9664
21	9.1381	-5.5674	-4.4778	3.9549	3.5219	3.3465	0.6396	1.9132	-0.0564	-2.1244	-1.108	0.3135	-0.4596	-1.0416	0.4274	0.8002	0.1833	-0.1494	0.7875	-0.0105	0.7018	53.526	28.7522	11.748
22	4.1119	-4.4863	-5.4133	4.9868	5.7755	9.4581	0.5789	2.1494	-0.0833	-1.8222	-0.6557	0.4915	-0.1034	0.9553	0.0841	0.7177	0.2091	-0.0093	1.0793	0.1182	0.6299	52.154	37.0166	10.9737
23	5.5012	1.2794	1.8676	3.0726	2.1292	1.6686	0.2743	-0.1536	-0.0426	0.2385	-0.3661	-0.5085	-0.0494	0.2743	0.1212	0.1362	0.0593	-0.0148	0.2137	0.0631	0.277	44.1005	34.8746	27.8727
24	1.2532	1.7257	-0.5832	6.9722	-2.5073	7.6991	0.0436	0.419	-0.0485	-0.4295	-0.1008	-0.4449	0.1301	0.2196	0.0425	0.195	0.035	0.0449	0.3063	0.0374	0.2367	35.3531	33.9084	17.295
25	8.438	6.3477	3.803	5.0393	3.4977	5.2643	0.4809	0.5319	-1.1336	0.2005	0.1625	-0.9453	0.5669	0.6568	-0.6465	0.2728	0.0688	-0.084	0.3713	-0.0513	0.4778	50.3459	26.7168	27.6879
26	7.2691	3.9605	-1.7496	3.2585	1.5172	5.9738	0.082	0.5063	0.5929	-0.3394	-0.2307	-0.7776	-0.3823	0.6498	0.1879	0.1961	0.0123	0.023	0.3222	0.0983	0.482	44.9649	54.2159	37.6604
27	3.8783	3.0884	3.9379	6.5904	4.9245	5.0353	0.0807	-0.7608	-0.8537	1.0579	-0.3656	0.4802	1.431	-0.3414	0.1698	0.4343	0.0507	0.1349	0.3595	0.1095	0.4409	34.4181	39.9885	43.5577
28	7.7558	-3.2025	2.6348	6.118	-2.008	6.5522	0.2531	0.089	0.0251	-0.0975	-0.0539	-0.0416	-0.0072	0.0852	-0.2123	0.1359	-0.0016	0.0205	0.1275	0.0206	0.2514	39.6846	47.2199	34.4612
29	4.0882	5.2225	0.0559	9.1099	0.6831	1.7511	0.0426	-2.3323	-0.0824	4.5997	0.2245	-2.0739	0.0348	0.3163	-0.2048	1.0007	0.1293	-0.2306	0.8986	-0.0105	0.7611	50.6528	46.8395	54.8676
30	6.5842	-5.3334	-2.0874	9.3641	2.2069	8.1683	-0.1478	-0.4112	-0.7158	1.1993	-0.4342	-0.2233	0.257	-0.0807	0.5319	0.4111	-0.0513	-0.055	0.5098	0.1075	0.4421	45.7082	46.0658	50.9507
31	3.4505	-0.1755	-2.058	1.2734	0.8796	3.6262	0.1337	-0.209	0.1464	0.1687	-0.0128	-0.2	-0.0255	0.098	-0.1197	0.1773	-0.0205	-0.0582	0.1861	0.0535	0.3013	34.8859	52.3047	43.6694
32	5.8315	-4.4135	-1.6988	3.4224	0.8047	4.4044	-0.0126	-0.8861	0.66	0.1706	0.0023	-0.8831	-0.3383	0.9792	-0.0673	0.2338	-0.0551	-0.0156	0.4747	0.0707	0.5045	51.9773	53.501	42.0914
33	1.9098	0.3083	-2.0688	5.0736	-1.836	8.1471	0.0312	0.7211	0.6442	-0.1541	0.2986	0.4057	-0.1893	-0.5795	-0.3946	0.2786	-0.0145	-0.0345	0.4152	0.1678	0.3065	15.6956	48.9206	11.0868
34	1.2131	-1.0586	-0.0859	2.942	-0.7413	1.776	-0.0498	0.7423	0.1158	-0.4616	0.1916	0.4054	-0.0441	-0.4002	0.0219	0.4099	0.0083	-0.0229	0.594	0.2384	0.3432	17.6059	51.8575	9.2645
35	3.7035	4.2486	1.2666	5.3428	3.261	7.4715	-0.4434	0.3825	-0.0451	-0.0316	0.2062	1.173	1.5704	-1.4373	0.2234	0.7859	-0.1395	-0.0684	0.9447	0.3583	0.8194	4.8604	46.506	1.9815
36	0.1537	-0.5927	0.4077	2.2648	-1.4405	2.5879	-0.0226	0.4766	0.127	-0.4735	0.0655	0.0765	0.1331	-0.2393	-0.0802	0.3393	-0.0096	-0.0192	0.4903	0.1437	0.2558	17.755	43.3926	7.5331
37	4.0478	-1.304	-1.2111	2.5769	-0.7424	2.5475	-0.1375	-0.0802	0.0392	0.4426	0.3074	0.4765	-0.4115	-0.4963	-0.3394	0.4258	0.2066	0.1275	0.4556	0.2731	0.4567	13.8725	67.3151	22.0111
38	8.9737	5.5502	-0.6428	9.2051	-0.5844	6.8778	-0.1767	0.8855	-0.2288	-0.5525	0.3797	-1.5728	-0.0222	1.2384	-0.1662	0.276	0.0341	0.0892	0.6009	0.0797	0.4903	30.8031	59.9277	19.0266
39	2.2453	-0.3219	-0.4948	1.4327	0.5705	5.6039	-0.004	0.2474	-0.0267	-0.1987	0.2121	0.1864	0.059	-0.3326	-0.2097	0.245	0.0385	0.0062	0.3478	0.1728	0.3006	18.1079	59.0324	20.0991
40	5.3703	-0.4298	1.4996	0.0442	0.0564	3.7325	0.0222	0.5689	1.643	-0.8941	0.1854	-0.298	-1.8227	0.2888	-0.0103	0.9182	0.0035	0.138	0.4519	0.2592	0.8766	26.8142	76.9411	15.2886
41	0.0243	-0.2589	0.3243	3.7196	-2.5828	5.0901	0.0439	0.1075	0.0942	-0.1059	0.0432	0.039	-0.1786	-0.2354	-0.4091	0.3924	0.1169	0.103	0.4607	0.2676	0.3771	17.6364	64.5066	17.577
42	1.4392	-1.251	0.8348	1.5152	0.0078	1.7687	0.1616	0.1783	0.6999	-0.0608	0.0918	-0.2886	-0.425	-0.1531	-0.1679	0.3249	0.0418	0.0809	0.2553	0.1358	0.4214	25.1548	65.5056	30.0256
43	0.378	-0.3208	0.7999	1.2411	-1.1868	2.0341	-0.1491	0.0202	0.1483	0.2198	-0.0335	-0.1541	-0.4659	-0.0564	-0.0735	0.5066	0.204	0.0861	0.6423	0.4862	0.651	13.6948	73.9225	16.8709

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 2 through 9 )
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 10 through 18 )
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 19 through 39 )
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 40 through 49 )
5	X-RAY DIFFRACTION	5	chain 'A' and (resid 50 through 58 )
6	X-RAY DIFFRACTION	6	chain 'A' and (resid 59 through 89 )
7	X-RAY DIFFRACTION	7	chain 'A' and (resid 90 through 113 )
8	X-RAY DIFFRACTION	8	chain 'A' and (resid 114 through 121 )
9	X-RAY DIFFRACTION	9	chain 'A' and (resid 122 through 136 )
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 2 through 9 )
11	X-RAY DIFFRACTION	11	chain 'B' and (resid 10 through 18 )
12	X-RAY DIFFRACTION	12	chain 'B' and (resid 19 through 41 )
13	X-RAY DIFFRACTION	13	chain 'B' and (resid 42 through 68 )
14	X-RAY DIFFRACTION	14	chain 'B' and (resid 69 through 77 )
15	X-RAY DIFFRACTION	15	chain 'B' and (resid 78 through 107 )
16	X-RAY DIFFRACTION	16	chain 'B' and (resid 108 through 113 )
17	X-RAY DIFFRACTION	17	chain 'B' and (resid 114 through 121 )
18	X-RAY DIFFRACTION	18	chain 'B' and (resid 122 through 136 )
19	X-RAY DIFFRACTION	19	chain 'C' and (resid 2 through 18 )
20	X-RAY DIFFRACTION	20	chain 'C' and (resid 19 through 49 )
21	X-RAY DIFFRACTION	21	chain 'C' and (resid 50 through 56 )
22	X-RAY DIFFRACTION	22	chain 'C' and (resid 57 through 66 )
23	X-RAY DIFFRACTION	23	chain 'C' and (resid 67 through 80 )
24	X-RAY DIFFRACTION	24	chain 'C' and (resid 81 through 121 )
25	X-RAY DIFFRACTION	25	chain 'C' and (resid 122 through 136 )
26	X-RAY DIFFRACTION	26	chain 'D' and (resid 2 through 9 )
27	X-RAY DIFFRACTION	27	chain 'D' and (resid 10 through 18 )
28	X-RAY DIFFRACTION	28	chain 'D' and (resid 19 through 41 )
29	X-RAY DIFFRACTION	29	chain 'D' and (resid 42 through 61 )
30	X-RAY DIFFRACTION	30	chain 'D' and (resid 62 through 68 )
31	X-RAY DIFFRACTION	31	chain 'D' and (resid 69 through 121 )
32	X-RAY DIFFRACTION	32	chain 'D' and (resid 122 through 136 )
33	X-RAY DIFFRACTION	33	chain 'E' and (resid 2 through 18 )
34	X-RAY DIFFRACTION	34	chain 'E' and (resid 19 through 49 )
35	X-RAY DIFFRACTION	35	chain 'E' and (resid 50 through 70 )
36	X-RAY DIFFRACTION	36	chain 'E' and (resid 71 through 136 )
37	X-RAY DIFFRACTION	37	chain 'F' and (resid 2 through 9 )
38	X-RAY DIFFRACTION	38	chain 'F' and (resid 10 through 18 )
39	X-RAY DIFFRACTION	39	chain 'F' and (resid 19 through 41 )
40	X-RAY DIFFRACTION	40	chain 'F' and (resid 42 through 68 )
41	X-RAY DIFFRACTION	41	chain 'F' and (resid 69 through 78 )
42	X-RAY DIFFRACTION	42	chain 'F' and (resid 79 through 121 )
43	X-RAY DIFFRACTION	43	chain 'F' and (resid 122 through 136 )

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