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- PDB-7nor: Crystal structure of Mycobacterium tuberculosis ArgF in complex w... -

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Basic information

Entry
Database: PDB / ID: 7nor
TitleCrystal structure of Mycobacterium tuberculosis ArgF in complex with 2-fluoro-4-hydroxybenzonitrile.
ComponentsOrnithine carbamoyltransferaseOrnithine transcarbamylase
KeywordsTRANSFERASE / ArgF / Ornithine Carbamoyltransferase
Function / homology
Function and homology information


ornithine carbamoyltransferase / ornithine carbamoyltransferase activity / citrulline biosynthetic process / arginine biosynthetic process via ornithine / arginine biosynthetic process / amino acid binding / cytoplasm
Similarity search - Function
Ornithine carbamoyltransferase / Ornithine/putrescine carbamoyltransferase / Aspartate and ornithine carbamoyltransferases signature. / Aspartate/ornithine carbamoyltransferase / Aspartate/ornithine carbamoyltransferase, Asp/Orn-binding domain / Aspartate/ornithine carbamoyltransferase, carbamoyl-P binding / Aspartate/ornithine carbamoyltransferase superfamily / Aspartate/ornithine carbamoyltransferase, Asp/Orn binding domain / Aspartate/ornithine carbamoyltransferase, carbamoyl-P binding domain
Similarity search - Domain/homology
2-fluoro-4-hydroxybenzonitrile / PHOSPHATE ION / Ornithine carbamoyltransferase
Similarity search - Component
Biological speciesMycobacterium tuberculosis H37Rv (bacteria)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / molecular replacement / Resolution: 1.59 Å
AuthorsMendes, V. / Gupta, P. / Burgess, A. / Sebastian-Perez, V. / Cattermole, E. / Meghir, C. / Blundell, T.L.
Funding support United States, 1items
OrganizationGrant numberCountry
Bill & Melinda Gates FoundationOPP1158806 United States
CitationJournal: Comput Struct Biotechnol J / Year: 2021
Title: A fragment-based approach to assess the ligandability of ArgB, ArgC, ArgD and ArgF in the L-arginine biosynthetic pathway of Mycobacterium tuberculosis
Authors: Gupta, P. / Thomas, S.E. / Zaidan, S.A. / Pasillas, M.A. / Cory-Wright, J. / Sebastian-Perez, V. / Burgess, A. / Cattermole, E. / Meghir, C. / Abell, C. / Coyne, A.G. / Jacobs, W.R. / ...Authors: Gupta, P. / Thomas, S.E. / Zaidan, S.A. / Pasillas, M.A. / Cory-Wright, J. / Sebastian-Perez, V. / Burgess, A. / Cattermole, E. / Meghir, C. / Abell, C. / Coyne, A.G. / Jacobs, W.R. / Blundell, T.L. / Tiwari, S. / Mendes, V.
History
DepositionFeb 25, 2021Deposition site: PDBE / Processing site: PDBE
Revision 1.0Jun 30, 2021Provider: repository / Type: Initial release
Revision 1.1Jan 31, 2024Group: 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

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Ornithine carbamoyltransferase
B: Ornithine carbamoyltransferase
C: Ornithine carbamoyltransferase
D: Ornithine carbamoyltransferase
E: Ornithine carbamoyltransferase
F: Ornithine carbamoyltransferase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)200,74820
Polymers199,2506
Non-polymers1,49814
Water28,9321606
1
A: Ornithine carbamoyltransferase
B: Ornithine carbamoyltransferase
C: Ornithine carbamoyltransferase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)100,46911
Polymers99,6253
Non-polymers8448
Water543
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area7970 Å2
ΔGint-67 kcal/mol
Surface area30860 Å2
MethodPISA
2
D: Ornithine carbamoyltransferase
E: Ornithine carbamoyltransferase
F: Ornithine carbamoyltransferase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)100,2799
Polymers99,6253
Non-polymers6546
Water543
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area7170 Å2
ΔGint-52 kcal/mol
Surface area30210 Å2
MethodPISA
Unit cell
Length a, b, c (Å)91.453, 142.734, 97.697
Angle α, β, γ (deg.)90.000, 117.500, 90.000
Int Tables number4
Space group name H-MP1211

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Components

#1: Protein
Ornithine carbamoyltransferase / Ornithine transcarbamylase / OTCase


Mass: 33208.324 Da / Num. of mol.: 6
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Mycobacterium tuberculosis H37Rv (bacteria)
Gene: argF, Rv1656, MTCY06H11.21 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: P9WIT9, ornithine carbamoyltransferase
#2: Chemical
ChemComp-PO4 / PHOSPHATE ION / Phosphate


Mass: 94.971 Da / Num. of mol.: 10 / Source method: obtained synthetically / Formula: PO4
#3: Chemical
ChemComp-8H8 / 2-fluoro-4-hydroxybenzonitrile


Mass: 137.111 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C7H4FNO / Feature type: SUBJECT OF INVESTIGATION
#4: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 1606 / Source method: isolated from a natural source / Formula: H2O
Has ligand of interestY

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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: 2.84 Å3/Da / Density % sol: 56.67 %
Crystal growTemperature: 291 K / Method: vapor diffusion
Details: 150 mM ammonium dihydrogen phosphate 10 mM praseodymium acetate

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: Diamond / Beamline: I04 / Wavelength: 0.9795 Å
DetectorType: DECTRIS PILATUS 6M-F / Detector: PIXEL / Date: Aug 6, 2018
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.9795 Å / Relative weight: 1
ReflectionResolution: 1.59→81.12 Å / Num. obs: 271697 / % possible obs: 92.2 % / Redundancy: 5.2 % / CC1/2: 0.999 / Rmerge(I) obs: 0.058 / Rpim(I) all: 0.027 / Rrim(I) all: 0.064 / Net I/σ(I): 13 / Num. measured all: 1416962
Reflection shell

Diffraction-ID: 1

Resolution (Å)Redundancy (%)Rmerge(I) obsNum. measured allNum. unique obsCC1/2Rpim(I) allRrim(I) allNet I/σ(I) obs% possible all
1.59-1.684.31.241114917268180.4270.6381.4020.962.3
5.04-81.125.20.0344910593920.9980.0160.03740.699

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Phasing

PhasingMethod: molecular replacement
Phasing MR
Highest resolutionLowest resolution
Rotation7.98 Å81.12 Å

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Processing

Software
NameVersionClassification
PHENIX1.18.2refinement
Aimless0.7.1data scaling
PHASER2.8.3phasing
PDB_EXTRACT3.27data extraction
XDSdata reduction
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 2P2G

2p2g


Resolution: 1.59→46.08 Å / SU ML: 0.17 / Cross valid method: THROUGHOUT / σ(F): 1.34 / Phase error: 19.39 / Stereochemistry target values: ML
RfactorNum. reflection% reflection
Rfree0.1861 13195 4.86 %
Rwork0.1668 258413 -
obs0.1677 271608 92.08 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso max: 102.2 Å2 / Biso mean: 34.3295 Å2 / Biso min: 17.19 Å2
Refinement stepCycle: final / Resolution: 1.59→46.08 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms13545 0 90 1607 15242
Biso mean--50.9 43.22 -
Num. residues----1810
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 30

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
1.59-1.610.35222500.31665020527053
1.61-1.630.34212880.3075437572558
1.63-1.650.29943090.28455892620164
1.65-1.670.2883390.27526423676269
1.67-1.690.30083520.25847211756377
1.69-1.720.26444510.24988270872189
1.72-1.740.24064890.23128926941596
1.74-1.770.22584030.22419068947197
1.77-1.80.22764630.21478987945097
1.8-1.820.2285040.20619020952497
1.82-1.860.23885360.19328965950197
1.86-1.890.22684530.19849078953197
1.89-1.930.22854970.20259135963298
1.93-1.970.20355350.18249031956698
1.97-2.010.20164650.17439105957098
2.01-2.060.2044900.16719113960398
2.06-2.110.18624470.16349134958198
2.11-2.160.18094690.15819206967598
2.16-2.230.17824310.16119220965198
2.23-2.30.19424390.16989200963998
2.3-2.380.19194780.16099190966898
2.38-2.480.19255000.16329202970299
2.48-2.590.18114420.15959262970499
2.59-2.730.18014910.16229205969699
2.73-2.90.19464830.16839245972899
2.9-3.120.17964210.16339331975299
3.12-3.430.16894640.16019307977199
3.43-3.930.17054170.14899438985599
3.93-4.950.1564650.13889357982299
4.95-46.080.17054240.17059435985999
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)
11.9377-0.8808-0.65991.57970.29141.14940.0273-0.0040.1156-0.00550.0227-0.0702-0.13560.0807-0.05140.2036-0.0191-0.01550.234-0.02740.21712.7271-3.575-41.2422
21.8177-0.4217-0.23222.49820.29440.22430.03360.2351-0.1208-0.3598-0.17930.3132-0.0971-0.27080.10970.22070.0178-0.03180.2615-0.02220.2516-8.888-5.7483-47.6585
32.3929-0.5843-1.12111.1819-1.20772.7704-0.03010.871-0.3139-0.5661-0.2571-0.10850.7098-0.23320.12250.53120.0520.01740.5360.00210.3892-4.23488.2047-59.3068
42.0235-0.4264-0.73651.68080.41211.68650.16830.40240.2293-0.7231-0.1379-0.2618-0.48630.0431-0.01210.37780.01370.03580.30510.04030.28532.71950.1014-55.9594
51.1211-0.6444-0.43291.54550.41160.7904-0.0212-0.011-0.0706-0.07270.06040.01760.01760.1391-0.02080.1679-0.012-0.01320.2555-0.01280.20678.5966-14.4671-46.4089
61.31550.23120.00961.50030.56611.3756-0.1018-0.0241-0.0643-0.09140.168-0.28860.03420.3033-0.04640.187-0.00290.01970.3169-0.03880.263418.7536-18.2091-51.5918
71.45750.3713-0.31310.9719-0.08833.2682-0.14050.1403-0.0158-0.12290.2048-0.0927-0.0048-0.2332-0.05930.2581-0.02660.02580.2607-0.00930.24367.9648-25.9507-59.9262
81.50330.2537-0.70832.35480.26851.8699-0.2656-0.053-0.19940.05850.04810.09170.3324-0.00660.16670.2842-0.00640.04110.246-0.00370.28224.7762-31.0478-47.9193
91.431-0.0695-0.55222.92730.21491.3286-0.007-0.08760.06460.13660.1015-0.1093-0.06780.0393-0.08270.16880.0078-0.00670.2653-0.00950.19761.3797-8.6095-40.2614
101.29920.3112-0.07091.70370.2951.2233-0.0975-0.162-0.38590.2877-0.08470.29240.2835-0.05010.18420.2348-0.02240.060.2577-0.03060.383-32.8407-19.7823-35.5721
110.86220.0732-0.27621.95310.87671.5846-0.04680.1-0.0083-0.1014-0.05490.2021-0.0961-0.0690.09330.199-0.0014-0.00780.2436-0.02380.2725-23.5056-8.1654-42.1507
121.4665-1.0634-0.59581.87660.24680.56550.07020.5466-0.4451-0.4156-0.23760.31260.0838-0.09060.11920.2596-0.0034-0.00930.3654-0.09280.3462-12.1358-17.5992-49.8559
131.17890.7010.02760.74210.34771.5658-0.00740.3279-0.2953-0.0076-0.05940.18430.1473-0.01130.09250.2018-0.01070.01010.2692-0.07580.3559-28.9724-19.6078-45.9605
141.32850.17520.87631.4716-0.40630.9984-0.00420.2246-0.45620.0251-0.17790.47390.2716-0.31010.08530.2033-0.06120.01620.3917-0.20250.5962-45.2759-23.5478-49.0149
152.5582-0.0969-0.32291.72980.34563.26880.192-0.3295-0.8290.1813-0.1450.3271.1301-0.0979-0.06910.4457-0.11580.05970.364-0.10510.8392-42.3753-33.1489-43.3357
161.87850.04370.15594.186-1.10170.65470.07240.6376-0.1034-1.0475-0.48330.71540.0589-0.5706-0.24320.0223-0.0969-0.14340.563-0.32860.7362-50.105-20.3505-56.0129
171.36330.31770.65820.7790.25110.7274-0.20750.03170.23-0.3851-0.15120.6218-0.2676-0.18520.1110.28850.0635-0.17220.5155-0.20520.7041-50.2285-9.1532-53.6202
182.4024-0.48070.85772.3645-0.21581.7415-0.0894-0.0442-0.09440.19880.0160.3492-0.1095-0.12140.07370.1933-0.01680.04480.2338-0.06240.3346-31.8936-11.9363-38.9681
191.516-0.3598-0.07291.7796-0.2231.62860.0626-0.11940.02540.0335-0.05460.2551-0.297-0.2954-0.01760.28670.0264-0.0090.2512-0.02370.26-25.275322.3122-48.4198
201.3314-0.16190.6591.80970.19421.9545-0.00070.0574-0.0176-0.1048-0.03790.09930.04140.02190.07280.2345-0.0008-0.0090.2379-0.01910.2356-21.29677.4396-45.3348
212.08220.03960.33971.3381-0.51411.3453-0.01380.4393-0.0879-0.4328-0.00480.15690.30370.15110.020.34210.0174-0.04880.2982-0.02240.2784-21.51482.6606-53.141
220.64520.1476-0.15471.5581-0.76811.275-0.01490.1387-0.0082-0.30730.03890.24250.0757-0.2043-0.02380.2850.0114-0.05940.2731-0.03420.2596-27.170811.9545-55.4935
231.58110.02910.1181.84490.3842.52710.00120.20540.24240.00010.0947-0.0406-0.3940.1263-0.04160.4555-0.0158-0.01040.2475-0.00630.2618-16.213529.7836-63.1597
240.7651-0.1046-0.39020.58390.07591.4453-0.02020.18520.0635-0.28380.03790.1181-0.3864-0.149-0.01660.42890.0207-0.05320.28260.00970.2467-21.51326.8217-66.4986
252.10960.2120.38852.48270.84334.31620.10680.28680.5074-0.1812-0.15120.5321-0.9602-0.7313-0.05610.45380.1323-0.06170.38680.04340.3749-30.364931.6744-63.1542
261.218-0.65730.08251.04210.0961.47270.09360.19950.078-0.2581-0.0592-0.0519-0.28520.0452-0.01250.4645-0.0225-0.00380.30860.01710.2601-14.581327.4223-69.548
272.37011.1041.27511.49810.9411.76360.00110.4992-0.2326-0.19140.1809-0.19570.03020.5622-0.0770.4439-0.0294-0.01170.41970.00620.2472-9.951721.7683-76.6454
282.2305-0.4924-0.43311.1455-0.51562.6482-0.09360.229-0.0432-0.0895-0.0296-0.1441-0.28290.53650.16650.3324-0.0475-0.00330.371-0.00210.2709-4.312922.6729-64.1848
292.63260.6166-0.73871.6023-0.65432.09360.1514-0.00940.06430.0591-0.06640.0576-0.19260.0111-0.00180.25290.0221-0.04520.2139-0.01480.2044-18.502117.1544-48.1749
302.1794-0.75770.03022.28130.55450.8245-0.0391-0.01560.01580.18820.0817-0.03370.015-0.0097-0.0370.22650.01860.02360.22880.0140.1853-21.92621.5559-21.6855
312.2201-0.92250.06231.163-0.14270.2322-0.187-0.35840.29790.3680.183-0.167-0.0434-0.0089-0.01360.32660.069-0.03840.2706-0.03660.2538-16.435125.4864-13.1369
322.4794-0.5002-0.64391.20550.09511.40280.0056-0.15270.53920.16970.1259-0.0042-0.16560.0051-0.1090.30.06950.04330.24090.00670.3248-35.993639.5765-14.0913
331.4777-0.739-1.05052.28550.13471.2002-0.2103-0.5398-0.13160.58990.21740.1260.16340.1821-0.03890.37630.09910.09680.380.07040.2992-43.744828.1185-6.1463
343.1746-0.0984-0.75331.78450.22421.37680.02730.1173-0.03240.16550.09640.039-0.0521-0.0632-0.11450.24670.03850.00540.20520.01210.2047-26.457621.851-22.2857
351.49910.3213-0.07591.6863-0.3682.37410.00030.1725-0.0016-0.1409-0.02550.13670.2711-0.64540.02280.2542-0.04980.00340.3190.00350.2253-32.9403-12.9133-13.1145
361.3281-0.1532-0.58321.90090.19371.8813-0.08170.0335-0.00120.306-0.0693-0.1058-0.0344-0.07440.15070.2999-0.0001-0.00320.21590.01360.2444-23.8427-0.1336-15.2304
372.0249-0.2276-0.04761.5645-0.8320.3796-0.0644-0.43110.10140.65980.0349-0.2566-0.64810.1343-0.02050.51210.0113-0.03360.29110.01670.2726-22.87454.2217-7.6193
380.72390.1522-0.16031.8301-0.63250.95350.0807-0.11410.24020.56410.1020.4156-0.6514-0.5024-0.13610.460.13080.08240.35660.00620.3252-35.31875.4764-6.094
390.70380.34160.03311.1135-0.1461.9363-0.06-0.0217-0.03410.0528-0.0254-0.00280.1194-0.21590.09350.2582-0.02160.04550.24810.00580.2466-27.9223-11.451-5.7003
400.7946-0.0117-0.02441.55140.61793.1136-0.04240.1637-0.1727-0.09450.1298-0.09640.6061-0.1896-0.03560.3975-0.09510.04860.25720.00630.2565-28.0787-23.20011.7496
410.97690.1324-0.5751.3498-0.40412.3558-0.07840.0603-0.1208-0.05520.08520.15970.417-0.52440.02080.312-0.11120.04380.30870.00110.2328-34.5538-21.06554.9032
421.6429-0.2461-0.02161.4772-0.01342.4318-0.0358-0.2679-0.00510.0137-0.0957-0.10730.11970.05750.12190.3173-0.01880.04280.23030.01330.2503-21.4124-18.343112.6947
431.81960.02980.39171.4587-0.25162.5389-0.1640.006-0.16680.0061-0.0342-0.05730.42320.26590.21220.35110.03270.06380.23020.02370.2977-14.9805-22.49195.3406
442.6675-1.18260.7022.1724-1.3752.5907-0.0264-0.13920.0879-0.17840.0495-0.05910.1878-0.31270.03130.2544-0.02340.04080.2278-0.01120.2395-24.6928-10.294-12.7163
452.23290.51280.33481.3860.66961.69640.0018-0.0493-0.06020.16170.0245-0.07190.0723-0.0143-0.02260.2475-0.0049-0.00140.1698-0.0080.22530.89393.7229-16.5099
460.69850.13370.12511.0591-1.12791.22210.0565-0.4129-0.0560.5172-0.1295-0.0584-0.3301-0.0320.10110.4257-0.07490.0230.40380.0160.3177-9.475-3.5475-2.8283
471.8560.3636-0.0651.3090.92911.24740.0109-0.2245-0.08230.38950.0168-0.06450.24410.0511-0.01150.33480.0063-0.03650.22180.00330.22374.65243.9031-8.0353
481.61850.14481.29041.4469-0.07922.0301-0.0527-0.0319-0.0360.20690.0845-0.2729-0.18310.2185-0.02220.303-0.0238-0.0740.2791-0.03780.314119.749914.6235-5.0523
491.35320.31780.83531.98750.30351.5684-0.20450.00910.11520.0192-0.0254-0.1492-0.3828-0.00850.23110.4017-0.017-0.09370.2353-0.02740.325212.831727.5014-9.8384
501.79480.35170.69313.1558-0.19951.4321-0.11920.021-0.0617-0.06450.188-0.1058-0.0050.0002-0.06050.2270.00450.00190.2296-0.01770.21563.26347.2529-18.2167
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 0 through 50 )A0 - 50
2X-RAY DIFFRACTION2chain 'A' and (resid 51 through 75 )A51 - 75
3X-RAY DIFFRACTION3chain 'A' and (resid 76 through 94 )A76 - 94
4X-RAY DIFFRACTION4chain 'A' and (resid 95 through 114 )A95 - 114
5X-RAY DIFFRACTION5chain 'A' and (resid 115 through 159 )A115 - 159
6X-RAY DIFFRACTION6chain 'A' and (resid 160 through 215 )A160 - 215
7X-RAY DIFFRACTION7chain 'A' and (resid 216 through 245 )A216 - 245
8X-RAY DIFFRACTION8chain 'A' and (resid 246 through 284 )A246 - 284
9X-RAY DIFFRACTION9chain 'A' and (resid 285 through 307 )A285 - 307
10X-RAY DIFFRACTION10chain 'B' and (resid 1 through 28 )B1 - 28
11X-RAY DIFFRACTION11chain 'B' and (resid 29 through 64 )B29 - 64
12X-RAY DIFFRACTION12chain 'B' and (resid 65 through 94 )B65 - 94
13X-RAY DIFFRACTION13chain 'B' and (resid 95 through 143 )B95 - 143
14X-RAY DIFFRACTION14chain 'B' and (resid 144 through 187 )B144 - 187
15X-RAY DIFFRACTION15chain 'B' and (resid 188 through 201 )B188 - 201
16X-RAY DIFFRACTION16chain 'B' and (resid 202 through 245 )B202 - 245
17X-RAY DIFFRACTION17chain 'B' and (resid 246 through 284 )B246 - 284
18X-RAY DIFFRACTION18chain 'B' and (resid 285 through 307 )B285 - 307
19X-RAY DIFFRACTION19chain 'C' and (resid 1 through 28 )C1 - 28
20X-RAY DIFFRACTION20chain 'C' and (resid 29 through 50 )C29 - 50
21X-RAY DIFFRACTION21chain 'C' and (resid 51 through 83 )C51 - 83
22X-RAY DIFFRACTION22chain 'C' and (resid 84 through 143 )C84 - 143
23X-RAY DIFFRACTION23chain 'C' and (resid 144 through 159 )C144 - 159
24X-RAY DIFFRACTION24chain 'C' and (resid 160 through 187 )C160 - 187
25X-RAY DIFFRACTION25chain 'C' and (resid 188 through 201 )C188 - 201
26X-RAY DIFFRACTION26chain 'C' and (resid 202 through 231 )C202 - 231
27X-RAY DIFFRACTION27chain 'C' and (resid 232 through 254 )C232 - 254
28X-RAY DIFFRACTION28chain 'C' and (resid 255 through 284 )C255 - 284
29X-RAY DIFFRACTION29chain 'C' and (resid 285 through 307 )C285 - 307
30X-RAY DIFFRACTION30chain 'D' and (resid 1 through 64 )D1 - 64
31X-RAY DIFFRACTION31chain 'D' and (resid 65 through 143 )D65 - 143
32X-RAY DIFFRACTION32chain 'D' and (resid 144 through 223 )D144 - 223
33X-RAY DIFFRACTION33chain 'D' and (resid 224 through 284 )D224 - 284
34X-RAY DIFFRACTION34chain 'D' and (resid 285 through 307 )D285 - 307
35X-RAY DIFFRACTION35chain 'E' and (resid 1 through 28 )E1 - 28
36X-RAY DIFFRACTION36chain 'E' and (resid 29 through 50 )E29 - 50
37X-RAY DIFFRACTION37chain 'E' and (resid 51 through 83 )E51 - 83
38X-RAY DIFFRACTION38chain 'E' and (resid 84 through 114 )E84 - 114
39X-RAY DIFFRACTION39chain 'E' and (resid 115 through 143 )E115 - 143
40X-RAY DIFFRACTION40chain 'E' and (resid 144 through 159 )E144 - 159
41X-RAY DIFFRACTION41chain 'E' and (resid 160 through 215 )E160 - 215
42X-RAY DIFFRACTION42chain 'E' and (resid 216 through 245 )E216 - 245
43X-RAY DIFFRACTION43chain 'E' and (resid 246 through 284 )E246 - 284
44X-RAY DIFFRACTION44chain 'E' and (resid 285 through 307 )E285 - 307
45X-RAY DIFFRACTION45chain 'F' and (resid 0 through 64 )F0 - 64
46X-RAY DIFFRACTION46chain 'F' and (resid 65 through 94 )F65 - 94
47X-RAY DIFFRACTION47chain 'F' and (resid 95 through 143 )F95 - 143
48X-RAY DIFFRACTION48chain 'F' and (resid 144 through 245 )F144 - 245
49X-RAY DIFFRACTION49chain 'F' and (resid 246 through 284 )F246 - 284
50X-RAY DIFFRACTION50chain 'F' and (resid 285 through 307 )F285 - 307

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