PDB-5ipn: SigmaS-transcription initiation complex with 4-nt nascent RNA

ID or keywords:

Entry

Database: PDB / ID: 5ipn

Title

SigmaS-transcription initiation complex with 4-nt nascent RNA

Components

(DNA-directed RNA polymerase subunit ...Polymerase) x 4
Nascent RNA 4-mer
RNA polymerase sigma factor RpoS
synthetic non-template strand DNA (50-MER)
synthetic template strand DNA (50-MER)

Keywords

TRANSCRIPTION / TRANSFERASE/DNA/RNA /

Transcription initiation /

RNA polymerase / general stress sigma factor / pyrophosphate release / TRANSFERASE-DNA-RNA complex

Function / homology

Function and homology information

bacterial-type RNA polymerase core enzyme binding / sigma factor antagonist complex /

RNA polymerase complex / submerged biofilm formation / cellular response to cell envelope stress / cytosolic DNA-directed RNA polymerase complex / regulation of DNA-templated transcription initiation / bacterial-type flagellum assembly /

sigma factor activity / bacterial-type flagellum-dependent cell motility ...
Similarity search - Function

RNA polymerase sigma factor RpoS / Sigma-70 factors family signature 1. / RNA polymerase sigma-70 region 1.2 / Sigma-70 factor, region 1.2 / RNA polymerase sigma-70 region 3 / Sigma-70 region 3 / Sigma-70 factors family signature 2. / RNA polymerase sigma-70 / RNA polymerase sigma-70 region 4 /

Sigma-70, region 4 ...RNA polymerase sigma factor RpoS / Sigma-70 factors family signature 1. / RNA polymerase sigma-70 region 1.2 / Sigma-70 factor, region 1.2 / RNA polymerase sigma-70 region 3 / Sigma-70 region 3 / Sigma-70 factors family signature 2. / RNA polymerase sigma-70 / RNA polymerase sigma-70 region 4 /

Sigma-70, region 4 / RNA polymerase sigma-70 region 2 / RNA polymerase sigma-70 like domain / Sigma-70 region 2 / RNA polymerase sigma factor, region 2 / RNA polymerase sigma factor, region 3/4-like /

DNA-directed RNA polymerase, omega subunit /

DNA-directed RNA polymerase, subunit beta-prime, bacterial type /

DNA-directed RNA polymerase, beta subunit, external 1 domain superfamily /

DNA-directed RNA polymerase, beta subunit, external 1 domain / RNA polymerase beta subunit external 1 domain /

RNA polymerase, alpha subunit, C-terminal / Bacterial RNA polymerase, alpha chain C terminal domain /

DNA-directed RNA polymerase, alpha subunit / DNA-directed RNA polymerase beta subunit, bacterial-type / RNA polymerase Rpb6 /

RNA polymerase, subunit omega/Rpo6/RPB6 / RNA polymerase Rpb6 / RNA polymerase Rpb1, domain 3 superfamily / RNA polymerase Rpb1, clamp domain superfamily / RPB6/omega subunit-like superfamily /

DNA-directed RNA polymerase, subunit beta-prime / RNA polymerase Rpb1, domain 3 / RNA polymerase Rpb1, domain 3 / RNA polymerase Rpb2, domain 2 superfamily / RNA polymerase Rpb1, domain 1 / RNA polymerase Rpb1, domain 1 /

RNA polymerase, alpha subunit / RNA polymerase Rpb1, domain 4 / RNA polymerase Rpb1, domain 2 / RNA polymerase Rpb1, domain 4 /

RNA polymerase, N-terminal / RNA polymerase Rpb1, funnel domain superfamily /

RNA polymerase I subunit A N-terminus / RNA polymerase Rpb1, domain 5 / RNA polymerase Rpb1, domain 5 /

RNA polymerase, beta subunit, protrusion / RNA polymerase beta subunit /

DNA-directed RNA polymerase, insert domain /

DNA-directed RNA polymerase, RpoA/D/Rpb3-type / RNA polymerase Rpb3/RpoA insert domain / RNA polymerase Rpb3/Rpb11 dimerisation domain / RNA polymerases D /

DNA-directed RNA polymerase, insert domain superfamily /

RNA polymerase, RBP11-like subunit / RNA polymerase Rpb2, domain 2 / RNA polymerase Rpb2, domain 2 /

RNA polymerase, beta subunit, conserved site / RNA polymerase Rpb2, domain 7 / RNA polymerase Rpb2, domain 3 / RNA polymerase Rpb2, OB-fold / RNA polymerase Rpb2, domain 7 / RNA polymerase Rpb2, domain 3 / RNA polymerases beta chain signature. /

DNA-directed RNA polymerase, subunit 2, hybrid-binding domain /

DNA-directed RNA polymerase, subunit 2 /

DNA-directed RNA polymerase, subunit 2, hybrid-binding domain superfamily / RNA polymerase Rpb2, domain 6 / Winged helix-like DNA-binding domain superfamily
Similarity search - Domain/homology

Biological species

Escherichia coli (E. coli)
synthetic construct (others)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 4.61 Å

Authors

Liu, B. / Zuo, Y. / Steitz, T.A.

Citation

Journal: Proc.Natl.Acad.Sci.USA / Year: 2016
Title: Structures of E. coli sigma S-transcription initiation complexes provide new insights into polymerase mechanism.
Authors: Liu, B. / Zuo, Y. / Steitz, T.A.

History

Deposition	Mar 9, 2016	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Mar 30, 2016	Provider: repository / Type: Initial release
Revision 1.1	Apr 13, 2016	Group: Database references
Revision 1.2	Jun 22, 2016	Group: Database references

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	5ipn.cif.gz	1.5 MB	Display	PDBx/mmCIF format
PDB format	pdb5ipn.ent.gz	1.3 MB	Display	PDB format
PDBx/mmJSON format	5ipn.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/ip/5ipn ftp://data.pdbj.org/pub/pdb/validation_reports/ip/5ipn	HTTPS FTP

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Related structure data

Related structure data	5iplC 5ipmC C: citing same article (ref.)
Similar structure data	6utz-d 6uu2-d 6uu9-d 6uu5-d 6uu7-d 6uu3-d 6uu8-d 6uty-d 6uub-d 6uu0-d 6utx-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

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Links

PDB pages	PDBj / wwPDB / NCBI
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PDB pages

PDBj /

wwPDB /

NCBI

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Deposited unit

A: DNA-directed RNA polymerase subunit alpha

B: DNA-directed RNA polymerase subunit alpha

C: DNA-directed RNA polymerase subunit beta

D: DNA-directed RNA polymerase subunit beta'

E: DNA-directed RNA polymerase subunit omega

F: RNA polymerase sigma factor RpoS

1: synthetic non-template strand DNA (50-MER)

2: synthetic template strand DNA (50-MER)

3: Nascent RNA 4-mer

hetero molecules

441 kDa, 9 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)	132.874, 152.170, 229.120
Angle α, β, γ (deg.)	90.00, 90.00, 90.00
Int Tables number	19
Space group name H-M	P2₁2₁2₁

Noncrystallographic symmetry (NCS)

NCS domain:

ID	Ens-ID	Details
1	1	A
2	1	B

NCS domain segments:

Dom-ID	Component-ID	Ens-ID	Refine code	Auth asym-ID	Auth seq-ID
1	0	1	0	A	6 - 232
2	0	1	0	B	6 - 232

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DNA-directed RNA polymerase subunit ... , 4 types, 5 molecules ABCDE

#1: Protein	DNA-directed RNA polymerase subunit alpha / Polymerase / RNAP subunit alpha / RNA polymerase subunit alpha / Transcriptase subunit alpha Mass: 26899.572 Da / Num. of mol.: 2 / Fragment: UNP residues 1-235 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli (E. coli) / Gene: rpoA, pez, phs, sez, b3295, JW3257 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P0A7Z4, DNA-directed RNA polymerase
#2: Protein	DNA-directed RNA polymerase subunit beta / Polymerase / RNAP subunit beta / RNA polymerase subunit beta / Transcriptase subunit beta Mass: 150820.875 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli (E. coli) Gene: rpoB, groN, nitB, rif, ron, stl, stv, tabD, b3987, JW3950 Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P0A8V2, DNA-directed RNA polymerase
#3: Protein	DNA-directed RNA polymerase subunit beta' / Polymerase / RNAP subunit beta' / RNA polymerase subunit beta' / Transcriptase subunit beta' Mass: 155366.781 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli (E. coli) / Gene: rpoC, tabB, b3988, JW3951 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P0A8T7, DNA-directed RNA polymerase
#4: Protein	DNA-directed RNA polymerase subunit omega / Polymerase / RNAP omega subunit / RNA polymerase omega subunit / Transcriptase subunit omega Mass: 10118.352 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli (E. coli) / Gene: rpoZ, b3649, JW3624 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P0A800, DNA-directed RNA polymerase

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DNA chain , 2 types, 2 molecules 12

#6: DNA chain	synthetic non-template strand DNA (50-MER) Mass: 15329.811 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)
#7: DNA chain	synthetic template strand DNA (50-MER) Mass: 15547.958 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)

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Protein / RNA chain , 2 types, 2 molecules F3

#5: Protein	RNA polymerase sigma factor RpoS / Sigma S / Sigma-38 Mass: 38777.602 Da / Num. of mol.: 1 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli (E. coli) / Gene: rpoS, appR, katF, nur, otsX, sigS, b2741, JW5437 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P13445
#8: RNA chain	Nascent RNA 4-mer Mass: 1440.785 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)

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Non-polymers , 2 types, 3 molecules

#9: Chemical	ChemComp-ZN / ZINC ION Mass: 65.409 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: Zn
#10: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: Mg

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 2.63 Å³/Da / Density % sol: 53.15 %
Crystal grow	Temperature: 295 K / Method: vapor diffusion, sitting drop / pH: 7.8 / Details: PEG3350, sodium chloride, HEPES

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Data collection

Diffraction

Mean temperature: 100 K

Diffraction source

Source:

SYNCHROTRON / Site:

APS

/ Beamline: 24-ID-E / Wavelength: 0.97919 Å

Detector

Type: ADSC QUANTUM 315 / Detector: CCD / Date: Nov 26, 2014

Radiation

Monochromator: single crystal Si(220) side bounce / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray

Radiation wavelength

ID	Wavelength (Å)	Relative weight
1	0.979	1
2	0.97919	1

Reflection

Resolution: 4.6→126.76 Å / Num. obs: 24772 / % possible obs: 99.3 % / Redundancy: 6.9 % / Net I/σ(I): 10.06

Reflection shell

Highest resolution: 4.6 Å

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Processing

Software

Name	Version	Classification
REFMAC	5.8.0123	refinement
HKL-2000		data reduction
HKL-2000		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 4.61→126.76 Å / Cor.coef. F_o:F_c: 0.901 / Cor.coef. F_o:F_c free: 0.86 / SU B: 520.539 / SU ML: 2.477 / Cross valid method: THROUGHOUT / ESU R Free: 1.755 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.34466	1233	4.7 %	RANDOM
R_work	0.27994	-	-	-
obs	0.28316	24772	98.81 %	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK

Displacement parameters

B_iso mean: 317.282 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-26.29 Å²	0 Å²	0 Å²
2-	-	13.42 Å²	0 Å²
3-	-	-	12.87 Å²

Refinement step

Cycle: LAST / Resolution: 4.61→126.76 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	27572	1452	3	0	29027

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.011	0.019	29597
X-RAY DIFFRACTION	r_bond_other_d	0.004	0.02	28286
X-RAY DIFFRACTION	r_angle_refined_deg	1.371	1.932	40269
X-RAY DIFFRACTION	r_angle_other_deg	0.862	3	65096
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	5.341	5	3505
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	23.806	24.064	1319
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	15.406	15	5172
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	14.702	15	263
X-RAY DIFFRACTION	r_chiral_restr	0.074	0.2	4517
X-RAY DIFFRACTION	r_gen_planes_refined	0.024	0.021	32440
X-RAY DIFFRACTION	r_gen_planes_other	0.02	0.02	6440
X-RAY DIFFRACTION	r_nbd_refined
X-RAY DIFFRACTION	r_nbd_other
X-RAY DIFFRACTION	r_nbtor_refined
X-RAY DIFFRACTION	r_nbtor_other
X-RAY DIFFRACTION	r_xyhbond_nbd_refined
X-RAY DIFFRACTION	r_xyhbond_nbd_other
X-RAY DIFFRACTION	r_metal_ion_refined
X-RAY DIFFRACTION	r_metal_ion_other
X-RAY DIFFRACTION	r_symmetry_vdw_refined
X-RAY DIFFRACTION	r_symmetry_vdw_other
X-RAY DIFFRACTION	r_symmetry_hbond_refined
X-RAY DIFFRACTION	r_symmetry_hbond_other
X-RAY DIFFRACTION	r_symmetry_metal_ion_refined
X-RAY DIFFRACTION	r_symmetry_metal_ion_other
X-RAY DIFFRACTION	r_mcbond_it	9.674	22.556	14053
X-RAY DIFFRACTION	r_mcbond_other	9.671	22.556	14052
X-RAY DIFFRACTION	r_mcangle_it	16.31	38.037	17547
X-RAY DIFFRACTION	r_mcangle_other	16.31	38.038	17548
X-RAY DIFFRACTION	r_scbond_it	10.001	24.016	15544
X-RAY DIFFRACTION	r_scbond_other	10.001	24.017	15543
X-RAY DIFFRACTION	r_scangle_it
X-RAY DIFFRACTION	r_scangle_other	17.086	40.179	22723
X-RAY DIFFRACTION	r_long_range_B_refined	30.247	58.978	131837
X-RAY DIFFRACTION	r_long_range_B_other	30.247	58.978	131836
X-RAY DIFFRACTION	r_rigid_bond_restr
X-RAY DIFFRACTION	r_sphericity_free
X-RAY DIFFRACTION	r_sphericity_bonded

Refine LS restraints NCS

Ens-ID: 1 / Number: 27364 / Refine-ID: X-RAY DIFFRACTION / Type: interatomic distance / Rms dev position: 0.06 Å / Weight position: 0.05

Dom-ID	Auth asym-ID
1	A
2	B

LS refinement shell

Resolution: 4.609→4.729 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.45	91	-
R_work	0.417	1659	-
obs	-	-	91.96 %

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	9.0004	2.3942	-1.1713	4.4575	1.4687	12.59	0.2986	0.0113	-1.8866	0.1274	0.2495	-0.5864	0.0603	0.8143	-0.5481	1.7032	0.2406	-0.1424	0.2492	0.3281	1.4145	1.087	-18.22	5.362
2	18.3206	-0.5382	-4.5618	1.1853	2.7064	7.2008	0.2365	-0.4773	-1.0481	0.4533	-0.2192	0.2844	1.4699	-0.8153	-0.0173	2.287	-0.1223	-0.278	0.6741	1.0892	2.1766	-32.915	-31.943	8.818
3	13.2503	7.3502	-0.2206	8.9836	-6.8075	9.2846	0.5479	-0.5924	0.1505	0.5966	-0.1751	0.1436	-0.3981	0.2768	-0.3728	1.9517	-0.0322	0.0865	1.6715	-0.3377	1.1552	29.717	2.973	1.716
4	9.6745	-0.6935	1.2617	0.7468	0.887	2.6507	-0.0813	-1.1394	0.3138	0.182	0.2251	-0.0282	-0.2497	-0.2619	-0.1439	2.1094	0.1691	-0.006	0.2484	0.0235	0.0616	-30.702	8.457	0.145
5	6.3924	-1.9957	1.9513	7.8551	-2.5025	3.591	0.184	1.9942	-0.4109	-0.53	0.11	-0.4549	-0.1025	1.4255	-0.294	2.3877	-0.1753	-0.021	1.1017	-0.3169	0.1202	-18.242	1.719	-41.133
6	6.4439	0.7184	-2.0566	1.6341	-0.101	9.1795	-0.0455	-0.5391	-1.233	0.0184	-0.2838	0.5071	0.3958	-1.9033	0.3293	2.3531	-0.0626	-0.3154	0.6489	0.3802	2.1242	-61.085	-29.867	-3.105
7	7.8017	2.7664	-4.0473	4.3428	0.3045	3.0116	-0.0395	0.1497	0.7093	0.2412	0.5736	0.0903	0.2511	0.1247	-0.5341	2.331	0.071	-0.0892	1.5993	-0.5232	2.5254	-31.716	-47.548	-51.388
8	14.486	1.1299	5.4131	1.8093	-0.0974	5.9782	0.3336	-0.2761	-0.4017	-0.3031	-0.2618	0.7515	0.3146	-1.2934	-0.0718	1.5419	-0.0601	0.1198	0.9385	0.3306	1.0771	-78.162	-3.504	-17.004
9	12.2002	2.0713	2.6638	7.7047	-1.0999	7.8864	0.021	0.2153	-1.0282	-0.4821	0.2476	-0.0566	0.6203	-0.459	-0.2686	1.4597	0.1969	-0.0441	0.3186	0.1226	0.21	-71.776	29.307	-29.767
10	13.8359	4.3939	6.1171	8.2348	6.1049	6.9671	-0.4127	-0.6073	1.4532	0.4613	0.2803	0.0867	-0.7194	-0.3643	0.1324	2.1138	0.1664	-0.0101	0.4169	0.2126	0.4299	-74.203	62.671	-29.227
11	11.2926	2.7601	1.6246	0.7696	0.442	0.3043	-0.302	1.5719	0.4013	0.1036	0.037	0.1415	-0.2112	0.009	0.265	2.4972	0.0005	0.0917	1.7539	0.151	1.8735	-28.821	49.761	-52.812
12	8.5928	0.5002	1.1006	3.1193	-0.2933	2.816	0.1142	0.3146	-0.9774	-0.1108	-0.1943	0.9859	-0.2387	-0.6163	0.0801	2.547	0.0619	-0.1943	0.5065	-0.4841	0.7905	-64.442	-3.031	-54.047
13	8.8633	0.3343	3.8855	7.6291	-1.5134	3.9833	-0.5554	1.336	0.0152	1.0223	0.6592	-0.0546	-0.9617	0.5332	-0.1038	3.631	-0.0238	-0.0119	1.4847	0.4969	1.0535	-28.421	52.691	-28.529
14	1.1557	-4.4226	-0.1894	18.1791	1.6545	0.7673	0.2086	-0.2045	-0.8068	-0.5055	-0.7284	3.4311	-0.0936	-1.0949	0.5198	2.067	-0.2307	-0.283	1.8869	-0.1422	1.8358	-40.553	-2.515	-24.166

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	6 - 51
2	X-RAY DIFFRACTION	1	A	179 - 235
3	X-RAY DIFFRACTION	1	B	6 - 51
4	X-RAY DIFFRACTION	1	B	179 - 233
5	X-RAY DIFFRACTION	2	A	52 - 178
6	X-RAY DIFFRACTION	3	B	52 - 178
7	X-RAY DIFFRACTION	4	C	3 - 28
8	X-RAY DIFFRACTION	4	C	146 - 152
9	X-RAY DIFFRACTION	4	C	445 - 455
10	X-RAY DIFFRACTION	4	C	517 - 831
11	X-RAY DIFFRACTION	4	C	1057 - 1241
12	X-RAY DIFFRACTION	4	D	501 - 790
13	X-RAY DIFFRACTION	5	C	1242 - 1320
14	X-RAY DIFFRACTION	5	D	343 - 500
15	X-RAY DIFFRACTION	5	D	791 - 938
16	X-RAY DIFFRACTION	5	D	1132 - 1153
17	X-RAY DIFFRACTION	5	D	1213 - 1317
18	X-RAY DIFFRACTION	5	D	1345 - 1376
19	X-RAY DIFFRACTION	5	D	1502 - 1503
20	X-RAY DIFFRACTION	5	E	2 - 80
21	X-RAY DIFFRACTION	5	F	220 - 244
22	X-RAY DIFFRACTION	6	C	832 - 891
23	X-RAY DIFFRACTION	6	C	912 - 1056
24	X-RAY DIFFRACTION	7	C	892 - 911
25	X-RAY DIFFRACTION	7	F	245 - 329
26	X-RAY DIFFRACTION	8	C	29 - 145
27	X-RAY DIFFRACTION	8	C	456 - 516
28	X-RAY DIFFRACTION	9	C	153 - 226
29	X-RAY DIFFRACTION	9	C	337 - 444
30	X-RAY DIFFRACTION	9	1	43 - 50
31	X-RAY DIFFRACTION	10	C	227 - 336
32	X-RAY DIFFRACTION	11	D	1154 - 1212
33	X-RAY DIFFRACTION	12	C	1321 - 1342
34	X-RAY DIFFRACTION	12	D	15 - 342
35	X-RAY DIFFRACTION	12	D	1318 - 1344
36	X-RAY DIFFRACTION	12	D	1501
37	X-RAY DIFFRACTION	12	F	53 - 219
38	X-RAY DIFFRACTION	12	1	27 - 42
39	X-RAY DIFFRACTION	12	2	22 - 36
40	X-RAY DIFFRACTION	12	1	51 - 59
41	X-RAY DIFFRACTION	12	2	4 - 12
42	X-RAY DIFFRACTION	13	D	939 - 1131
43	X-RAY DIFFRACTION	14	2	13 - 21
44	X-RAY DIFFRACTION	14	3	14 - 17

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