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- PDB-3v4j: First-In-Class Small Molecule Inhibitors of the Single-strand DNA... -

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Basic information

Entry
Database: PDB / ID: 3v4j
TitleFirst-In-Class Small Molecule Inhibitors of the Single-strand DNA Cytosine Deaminase APOBEC3G
ComponentsDNA dC->dU-editing enzyme APOBEC-3G
KeywordsHYDROLASE / APOBEC3G / ANTIVIRAL DEFENSE / HOST-VIRUS INTERACTION / METAL-BINDING / Nucleus
Function / homology
Function and homology information


apolipoprotein B mRNA editing enzyme complex / dCTP deaminase activity / cytidine deamination / base conversion or substitution editing / single-stranded DNA cytosine deaminase / DNA cytosine deamination / : / cytidine to uridine editing / cytidine deaminase activity / negative regulation of viral process ...apolipoprotein B mRNA editing enzyme complex / dCTP deaminase activity / cytidine deamination / base conversion or substitution editing / single-stranded DNA cytosine deaminase / DNA cytosine deamination / : / cytidine to uridine editing / cytidine deaminase activity / negative regulation of viral process / negative regulation of single stranded viral RNA replication via double stranded DNA intermediate / : / retrotransposon silencing / negative regulation of viral genome replication / APOBEC3G mediated resistance to HIV-1 infection / positive regulation of defense response to virus by host / Vif-mediated degradation of APOBEC3G / P-body / defense response to virus / ribonucleoprotein complex / innate immune response / RNA binding / zinc ion binding / identical protein binding / nucleus / cytoplasm / cytosol
Similarity search - Function
APOBEC-like C-terminal domain / Novel AID APOBEC clade 2 / APOBEC/CMP deaminase, zinc-binding / Cytidine and deoxycytidylate deaminases zinc-binding region signature. / Cytidine and deoxycytidylate deaminase domain / Cytidine and deoxycytidylate deaminases domain profile. / Cytidine deaminase-like
Similarity search - Domain/homology
4-[methyl(nitroso)amino]benzene-1,2-diol / DNA dC->dU-editing enzyme APOBEC-3G
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / MOLECULAR REPLACEMENT / molecular replacement / Resolution: 2.04 Å
AuthorsShandilya, S.M.D. / Ali, A. / Schiffer, C.A.
CitationJournal: Acs Chem.Biol. / Year: 2012
Title: First-In-Class Small Molecule Inhibitors of the Single-Strand DNA Cytosine Deaminase APOBEC3G.
Authors: Li, M. / Shandilya, S.M. / Carpenter, M.A. / Rathore, A. / Brown, W.L. / Perkins, A.L. / Harki, D.A. / Solberg, J. / Hook, D.J. / Pandey, K.K. / Parniak, M.A. / Johnson, J.R. / Krogan, N.J. ...Authors: Li, M. / Shandilya, S.M. / Carpenter, M.A. / Rathore, A. / Brown, W.L. / Perkins, A.L. / Harki, D.A. / Solberg, J. / Hook, D.J. / Pandey, K.K. / Parniak, M.A. / Johnson, J.R. / Krogan, N.J. / Somasundaran, M. / Ali, A. / Schiffer, C.A. / Harris, R.S.
History
DepositionDec 15, 2011Deposition site: RCSB / Processing site: RCSB
Revision 1.0Feb 1, 2012Provider: repository / Type: Initial release
Revision 1.1Mar 28, 2012Group: Database references
Revision 1.2Nov 8, 2017Group: Refinement description / Category: software
Item: _software.classification / _software.contact_author ..._software.classification / _software.contact_author / _software.contact_author_email / _software.date / _software.language / _software.location / _software.name / _software.type / _software.version
Revision 1.3Sep 13, 2023Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / pdbx_struct_conn_angle / struct_conn / struct_conn_type / 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_asym_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_seq_id / _pdbx_struct_conn_angle.ptnr2_auth_asym_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_asym_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_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.conn_type_id / _struct_conn.id / _struct_conn.pdbx_dist_value / _struct_conn.pdbx_leaving_atom_flag / _struct_conn.ptnr1_auth_asym_id / _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.ptnr2_auth_asym_id / _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_type.id / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: DNA dC->dU-editing enzyme APOBEC-3G
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)48,7748
Polymers48,1762
Non-polymers5986
Water2,774154
1
A: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,3874
Polymers24,0881
Non-polymers2993
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,3874
Polymers24,0881
Non-polymers2993
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
3
A: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules

B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)48,7748
Polymers48,1762
Non-polymers5986
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation1_656x+1,y,z+11
Buried area1600 Å2
ΔGint-170 kcal/mol
Surface area18030 Å2
MethodPISA
Unit cell
Length a, b, c (Å)53.080, 67.764, 64.472
Angle α, β, γ (deg.)90.00, 107.38, 90.00
Int Tables number4
Space group name H-MP1211

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Components

#1: Protein DNA dC->dU-editing enzyme APOBEC-3G / APOBEC-related cytidine deaminase / APOBEC-related protein / ARCD / APOBEC-related protein 9 / ARP- ...APOBEC-related cytidine deaminase / APOBEC-related protein / ARCD / APOBEC-related protein 9 / ARP-9 / CEM-15 / CEM15


Mass: 24088.059 Da / Num. of mol.: 2 / Fragment: C-Terminal Domain / Mutation: L234K, C243A, F310K, C321A, C356A
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: APOBEC3G, MDS019 / Plasmid: PGEX6P1 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) CodonPlus (RIL)
References: UniProt: Q9HC16, Hydrolases; Acting on carbon-nitrogen bonds, other than peptide bonds; In cyclic amidines
#2: Chemical
ChemComp-ZN / ZINC ION


Mass: 65.409 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: Zn
#3: Chemical ChemComp-PQR / 4-[methyl(nitroso)amino]benzene-1,2-diol / Methyl-3,4-dephostatin


Mass: 168.150 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C7H8N2O3
#4: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 154 / Source method: isolated from a natural source / Formula: H2O

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Experimental details

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Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

CrystalDensity Matthews: 2.3 Å3/Da / Density % sol: 46.45 %
Crystal growTemperature: 277 K / Method: vapor diffusion, sitting drop / pH: 7.5
Details: 0.1M HEPES, pH 7.5, 10% PEG 4000, 0.1M Magnesium Chloride, vapor diffusion, sitting drop, temperature 277K

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: ROTATING ANODE / Type: RIGAKU / Wavelength: 1.541 Å
DetectorType: RIGAKU RAXIS IV / Detector: IMAGE PLATE / Date: Sep 1, 2010
RadiationMonochromator: MIRRORS / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.541 Å / Relative weight: 1
ReflectionResolution: 2.04→61.53 Å / Num. obs: 26971 / % possible obs: 96.5 % / Redundancy: 5 % / Rmerge(I) obs: 0.061 / Net I/σ(I): 13.6
Reflection shell
Resolution (Å)Redundancy (%)Rmerge(I) obsDiffraction-ID% possible all
2.04-2.114.90.539194.3
2.11-2.250.365195
2.2-2.350.29195.6
2.3-2.4250.199195.7
2.42-2.5750.147196.4
2.57-2.7750.109196.9
2.77-3.0550.08197.4
3.05-3.4950.061198.1
3.49-4.3950.051198.4
4.39-504.90.039197.6

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Phasing

PhasingMethod: molecular replacement
Phasing MRRfactor: 34.95 / Model details: Phaser MODE: MR_AUTO
Highest resolutionLowest resolution
Rotation2.5 Å28.01 Å
Translation2.5 Å28.01 Å

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Processing

Software
NameVersionClassificationNB
DENZOdata reduction
SCALEPACKdata scaling
PHASER2.1.4phasing
REFMACrefmac_5.6.0081refinement
PDB_EXTRACT3.1data extraction
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: PDB ENTRY 3IR2

3ir2


Resolution: 2.04→28.01 Å / Cor.coef. Fo:Fc: 0.936 / Cor.coef. Fo:Fc free: 0.912 / Occupancy max: 1 / Occupancy min: 0.5 / SU B: 11.199 / SU ML: 0.166 / Isotropic thermal model: Isotropic / Cross valid method: THROUGHOUT / ESU R: 0.231 / ESU R Free: 0.201 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
RfactorNum. reflection% reflectionSelection details
Rfree0.27569 1329 4.9 %RANDOM
Rwork0.22825 ---
obs0.23064 25587 96.01 %-
Solvent computationIon probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: BABINET MODEL WITH MASK
Displacement parametersBiso mean: 49.441 Å2
Baniso -1Baniso -2Baniso -3
1-0.76 Å20 Å2-0.71 Å2
2---1.24 Å20 Å2
3---0.05 Å2
Refinement stepCycle: LAST / Resolution: 2.04→28.01 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms2874 0 28 154 3056
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.010.023024
X-RAY DIFFRACTIONr_bond_other_d0.0030.021953
X-RAY DIFFRACTIONr_angle_refined_deg1.3991.924127
X-RAY DIFFRACTIONr_angle_other_deg1.23234709
X-RAY DIFFRACTIONr_dihedral_angle_1_deg6.135373
X-RAY DIFFRACTIONr_dihedral_angle_2_deg35.36423.061147
X-RAY DIFFRACTIONr_dihedral_angle_3_deg19.57315416
X-RAY DIFFRACTIONr_dihedral_angle_4_deg22.5051517
X-RAY DIFFRACTIONr_chiral_restr0.0840.2430
X-RAY DIFFRACTIONr_gen_planes_refined0.0080.0213462
X-RAY DIFFRACTIONr_gen_planes_other0.0050.02709
X-RAY DIFFRACTIONr_nbd_refined
X-RAY DIFFRACTIONr_nbd_other
X-RAY DIFFRACTIONr_nbtor_refined
X-RAY DIFFRACTIONr_nbtor_other
X-RAY DIFFRACTIONr_xyhbond_nbd_refined
X-RAY DIFFRACTIONr_xyhbond_nbd_other
X-RAY DIFFRACTIONr_metal_ion_refined
X-RAY DIFFRACTIONr_metal_ion_other
X-RAY DIFFRACTIONr_symmetry_vdw_refined
X-RAY DIFFRACTIONr_symmetry_vdw_other
X-RAY DIFFRACTIONr_symmetry_hbond_refined
X-RAY DIFFRACTIONr_symmetry_hbond_other
X-RAY DIFFRACTIONr_symmetry_metal_ion_refined
X-RAY DIFFRACTIONr_symmetry_metal_ion_other
X-RAY DIFFRACTIONr_mcbond_it
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it
X-RAY DIFFRACTIONr_scbond_it
X-RAY DIFFRACTIONr_scangle_it
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
LS refinement shellResolution: 2.037→2.09 Å / Total num. of bins used: 20
RfactorNum. reflection% reflection
Rfree0.362 86 -
Rwork0.274 1698 -
obs--89.47 %
Refinement TLS params.

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

IDL11 (°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)
111.0227-0.2628-0.12453.1167-1.49510.72330.0665-0.754-0.08130.8414-0.01590.0273-0.40460.0049-0.05060.42540.0757-0.01450.43180.01670.1796-24.4936-21.352921.4621
23.35120.02062.48393.5124-1.99669.37610.0045-0.24640.23410.331-0.07050.2237-0.361-0.39190.0660.2628-0.00110.05010.262-0.03630.2584-24.7718-11.774215.8835
36.8592-0.98710.8582.51071.80011.9454-0.1227-0.32920.3846-0.06040.20060.0568-0.258-0.0448-0.07780.34130.00650.03860.29860.0180.2927-20.6606-4.895217.9217
43.0398-2.5718-2.15229.94187.32127.2736-0.12450.0728-0.24980.0176-0.04230.06990.09070.06080.16670.2169-0.00920.01790.24820.04170.2421-13.1633-27.36627.7504
55.21622.14335.49777.0763-2.740813.8898-0.1250.391-0.1957-0.68960.16090.25350.8162-0.1434-0.03590.33770.033-0.00220.3609-0.02870.3721-13.8452-33.6204-0.897
62.48393.55690.980226.259111.40275.14170.0155-0.0053-0.26270.2136-0.27230.47270.1645-0.20170.25670.3353-0.0096-0.03790.33540.05670.3074-14.4066-25.306916.2037
711.74522.27533.49248.29763.94479.1156-0.47890.03330.861-0.40590.2221-0.0805-0.93920.15710.25680.32140.0219-0.04620.2903-0.00270.2597-3.6501-9.876528.5256
84.4123-4.0167-0.49134.939-0.72511.1312-0.1349-0.1810.14980.20230.085-0.2755-0.10180.07990.050.2812-0.04520.00630.384-0.04420.2868-5.5579-14.001618.0382
90.01560.34020.166815.5537.06283.37-0.0268-0.01690.02370.8568-0.0522-0.32910.45830.13620.07910.39570.11880.05770.41530.10220.412-4.4396-25.018714.4632
107.0403-6.1838-0.826310.8251.65723.5157-0.06690.1663-0.1757-0.1860.0787-0.16610.20190.2035-0.01170.2418-0.01430.04410.2723-0.00730.2954-5.8879-30.10883.6921
112.7744-0.1993-0.24381.10760.67041.7660.02070.03480.2493-0.16110.0378-0.1903-0.12710.2066-0.05840.232-0.00050.00050.25960.00280.2467-10.9246-10.757311.1488
121.8896-0.74081.15697.74481.12621.9032-0.0865-0.03840.02090.05080.1558-0.37960.01980.2533-0.06930.19480.00210.04750.34190.02040.2854-1.5783-20.10655.0126
139.1268-6.4071-4.181414.06935.79956.7483-0.0450.4452-0.3383-0.4153-0.1285-0.10760.28170.04670.17350.20310.01090.00310.25940.03890.2444-16.2791-15.48635.3638
147.21473.19380.290110.55586.82874.9308-0.02050.13351.4727-0.4325-0.04070.5315-0.3445-0.09720.06110.5311-0.1086-0.13060.53030.0990.5974-11.36-1.954510.4754
150.89140.36480.74810.76692.783310.59290.0696-0.0122-0.0504-0.0872-0.0096-0.0476-0.3571-0.1203-0.060.1495-0.0040.04810.1434-0.0010.212-5.9322-4.73093.7437
161.8045-2.175-0.63745.0233.57643.53040.16390.3158-0.126-0.17270.0216-0.1138-0.09340.2711-0.18550.23430.0080.0370.2953-0.00270.3072-8.5819-13.45880.4517
174.04121.1682-0.74334.2017-0.38475.6046-0.0229-0.1501-0.36130.2722-0.0360.35220.4135-0.27460.05880.2017-0.01840.01020.2357-0.02460.2628-27.3464-21.841911.4106
184.3933-0.97840.767914.9742-3.30189.3703-0.0367-0.1956-0.09330.516-0.01240.7676-0.2532-0.5940.04910.18250.0377-0.01310.2651-0.04780.2534-31.3102-10.02677.7659
1916.80218.8957-10.033422.3722-0.841211.35830.06020.52910.067-0.5522-0.08970.0352-0.1933-0.51440.02950.26980.0409-0.04310.2880.02790.1957-23.056-5.78261.1674
2023.2663-2.2989-4.39957.7112-5.52325.58520.47660.8204-0.2138-0.3752-0.34620.14180.1307-0.0073-0.13030.31420.01550.01230.28020.05010.3228-14.7531-4.8431-1.0663
216.21871.0906-1.37486.14291.69085.69880.04530.24470.1553-0.3913-0.07490.5367-0.2344-0.57450.02960.1950.0072-0.0360.2433-0.03690.2283-38.7291-16.5568-12.8463
229.64992.02264.238912.4812-1.83652.48290.7004-0.0869-0.6594-0.2882-0.2480.32330.42370.0457-0.45240.5522-0.0257-0.02190.4205-0.07850.5561-32.7506-28.529-8.3972
235.40494.5545-0.15829.08641.87442.81710.0645-0.0977-0.0907-0.1381-0.23540.29330.2463-0.16210.17090.27380.0558-0.04540.3346-0.00450.243-33.2834-19.5748-18.472
246.14840.87680.09994.24874.71925.38340.2412-0.5584-0.34750.32570.149-0.49480.28040.1826-0.39020.5471-0.0693-0.14390.48820.05780.5708-14.4111.7151-16.6221
2518.874-1.516110.427111.52556.1510.0444-0.4022-0.72230.22240.82970.25460.01840.2566-0.24290.14760.4077-0.02310.05440.55770.13390.3828-18.1613-0.5951-14.6057
267.03179.20322.065519.79153.54210.7537-0.23870.65970.01790.10890.4876-0.3892-0.01230.226-0.24890.17460.03550.00890.2766-0.08340.3266-31.4568-7.3701-20.419
273.0060.43044.67940.06330.67077.28740.1245-0.1144-0.09470.03140.0015-0.02520.209-0.1655-0.1260.356-0.0156-0.02110.311-0.00090.2758-39.6339-23.0744-34.7712
283.93562.26411.17164.2485-0.03853.90840.02540.2064-0.2681-0.03010.07990.1470.10470.0758-0.10530.28340.0348-0.02510.3214-0.02780.3-30.312-18.8335-30.0165
294.51454.4234-1.33726.8361-3.08151.6595-0.76440.38040.5789-0.82260.50280.05550.1655-0.13520.26160.93130.0077-0.02260.46050.09260.446-26.1568-7.95-30.8183
301.78111.4125-0.03893.0476-0.30620.9945-0.06220.21750.3248-0.27730.1902-0.1798-0.22790.2167-0.1280.28020.01390.0460.3305-0.00960.308-21.7369-9.8084-21.5748
318.23027.00433.273432.5574-12.301510.0313-0.17910.4386-0.4955-1.035-0.1355-1.16050.54540.70570.31450.39260.09240.08950.4566-0.02520.3154-20.7424-23.3523-29.629
321.9154.37011.08517.6401-1.74492.96080.1080.0975-0.0446-0.4163-0.1021-0.23190.42270.3112-0.00590.29050.04660.1070.3855-0.03630.3246-16.2469-14.3387-29.1583
333.01375.1092-2.509311.8541-10.61615.72060.2440.09730.10860.25580.04390.0651-0.30830.5228-0.28790.32750.01580.12020.3631-0.05590.387-15.6223-9.3857-22.3158
343.4151-1.21850.88187.72291.3813.4789-0.00880.25450.1899-0.23880.0169-0.5768-0.12020.1575-0.00810.2340.0448-0.01240.29820.00420.2046-25.0541-21.3132-14.448
358.7037-6.131-1.790912.16356.917114.3327-0.2659-0.1886-0.5042-0.0939-0.12390.06361.01440.00920.38980.3650.00460.07550.3143-0.03550.4071-25.086-31.5229-22.8024
360.97713.49741.138815.81931.12996.9893-0.06490.1986-0.2504-0.5520.2055-0.39910.54260.119-0.14050.25210.06170.0880.4171-0.04180.4579-14.8135-25.1715-22.8312
371.94030.6629-1.63750.5765-0.39224.45310.0671-0.04780.0917-0.1646-0.0662-0.2591-0.12270.4763-0.00090.25110.01760.06660.27330.01170.344-20.8066-17.4608-11.3026
385.4035-1.44840.05213.9347-0.3573.5765-0.0593-0.130.20940.0494-0.06340.1757-0.1911-0.02680.12270.19980.00210.00320.228-0.03620.2488-34.1263-10.1308-7.3841
398.1537-7.685-0.40678.1105-1.17823.7597-0.191-0.2435-0.20380.36090.11240.10860.35470.11740.07860.501-0.0253-0.06550.3225-0.01520.3454-32.0265-22.5542-1.6602
4012.2666-0.129-8.41543.0682-1.065112.28380.182-0.0678-0.1812-0.2865-0.295-0.52560.06450.73650.1130.29380.0619-0.04080.25130.02070.2799-19.1565-27.7262-9.874
Refinement TLS group
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A196 - 200
2X-RAY DIFFRACTION2A201 - 209
3X-RAY DIFFRACTION3A210 - 218
4X-RAY DIFFRACTION4A219 - 228
5X-RAY DIFFRACTION5A229 - 235
6X-RAY DIFFRACTION6A236 - 244
7X-RAY DIFFRACTION7A245 - 254
8X-RAY DIFFRACTION8A255 - 260
9X-RAY DIFFRACTION9A261 - 269
10X-RAY DIFFRACTION10A270 - 281
11X-RAY DIFFRACTION11A282 - 291
12X-RAY DIFFRACTION12A292 - 307
13X-RAY DIFFRACTION13A308 - 313
14X-RAY DIFFRACTION14A314 - 319
15X-RAY DIFFRACTION15A320 - 326
16X-RAY DIFFRACTION16A327 - 337
17X-RAY DIFFRACTION17A338 - 358
18X-RAY DIFFRACTION18A359 - 367
19X-RAY DIFFRACTION19A368 - 373
20X-RAY DIFFRACTION20A374 - 379
21X-RAY DIFFRACTION21B196 - 206
22X-RAY DIFFRACTION22B207 - 211
23X-RAY DIFFRACTION23B212 - 224
24X-RAY DIFFRACTION24B225 - 230
25X-RAY DIFFRACTION25B231 - 235
26X-RAY DIFFRACTION26B236 - 243
27X-RAY DIFFRACTION27B244 - 252
28X-RAY DIFFRACTION28B253 - 262
29X-RAY DIFFRACTION29B263 - 268
30X-RAY DIFFRACTION30B269 - 288
31X-RAY DIFFRACTION31B289 - 294
32X-RAY DIFFRACTION32B295 - 301
33X-RAY DIFFRACTION33B302 - 308
34X-RAY DIFFRACTION34B309 - 314
35X-RAY DIFFRACTION35B315 - 320
36X-RAY DIFFRACTION36B321 - 330
37X-RAY DIFFRACTION37B331 - 341
38X-RAY DIFFRACTION38B342 - 358
39X-RAY DIFFRACTION39B359 - 366
40X-RAY DIFFRACTION40B367 - 380

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