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- PDB-4my1: Crystal Structure of the Inosine 5'-monophosphate Dehydrogenase, ... -

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Basic information

Entry
Database: PDB / ID: 4my1
TitleCrystal Structure of the Inosine 5'-monophosphate Dehydrogenase, with a Internal Deletion of CBS Domain from Bacillus anthracis str. Ames complexed with P68
ComponentsInosine-5'-monophosphate dehydrogenase
KeywordsOXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / Structural Genomics / NIAID / National Institute of Allergy and Infectious Diseases / Center for Structural Genomics of Infectious Diseases / CSGID / TIM-barrel / alpha-beta structure / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex
Function / homology
Function and homology information


IMP dehydrogenase activity / IMP dehydrogenase / GMP biosynthetic process / nucleotide binding / metal ion binding
Similarity search - Function
IMP dehydrogenase / GMP reductase domain / Inosine-5'-monophosphate dehydrogenase / IMP dehydrogenase / GMP reductase, conserved site / IMP dehydrogenase / GMP reductase signature. / IMP dehydrogenase/GMP reductase / IMP dehydrogenase / GMP reductase domain / CBS domain superfamily / Domain in cystathionine beta-synthase and other proteins. / CBS domain / CBS domain ...IMP dehydrogenase / GMP reductase domain / Inosine-5'-monophosphate dehydrogenase / IMP dehydrogenase / GMP reductase, conserved site / IMP dehydrogenase / GMP reductase signature. / IMP dehydrogenase/GMP reductase / IMP dehydrogenase / GMP reductase domain / CBS domain superfamily / Domain in cystathionine beta-synthase and other proteins. / CBS domain / CBS domain / CBS domain profile. / Aldolase class I / Aldolase-type TIM barrel / TIM Barrel / Alpha-Beta Barrel / Alpha Beta
Similarity search - Domain/homology
INOSINIC ACID / Chem-P68 / Inosine-5'-monophosphate dehydrogenase / Inosine-5'-monophosphate dehydrogenase
Similarity search - Component
Biological speciesBacillus anthracis (anthrax bacterium)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.5997 Å
AuthorsKim, Y. / Makowska-Grzyska, M. / Gu, M. / Gorla, S.K. / Hedstrom, L. / Anderson, W.F. / Joachimiak, A. / CSGID / Center for Structural Genomics of Infectious Diseases (CSGID)
CitationJournal: To be Published
Title: Crystal Structure of the Inosine 5'-monophosphate Dehydrogenase, with a Internal Deletion of CBS Domain from Bacillus anthracis str. Ames complexed with P68
Authors: Kim, Y. / Makowska-Grzyska, M. / Gu, M. / Anderson, W.F. / Joachimiak, A. / CSGID
History
DepositionSep 26, 2013Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jan 1, 2014Provider: repository / Type: Initial release
Revision 1.1May 17, 2017Group: Database references / Structure summary
Revision 1.2Jan 24, 2018Group: Structure summary / Category: audit_author / Item: _audit_author.name
Revision 1.3Sep 20, 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 / 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 / _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: Inosine-5'-monophosphate dehydrogenase
B: Inosine-5'-monophosphate dehydrogenase
C: Inosine-5'-monophosphate dehydrogenase
D: Inosine-5'-monophosphate dehydrogenase
E: Inosine-5'-monophosphate dehydrogenase
F: Inosine-5'-monophosphate dehydrogenase
G: Inosine-5'-monophosphate dehydrogenase
H: Inosine-5'-monophosphate dehydrogenase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)331,58424
Polymers325,6778
Non-polymers5,90816
Water2,108117
1
A: Inosine-5'-monophosphate dehydrogenase
B: Inosine-5'-monophosphate dehydrogenase
C: Inosine-5'-monophosphate dehydrogenase
D: Inosine-5'-monophosphate dehydrogenase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)165,79212
Polymers162,8384
Non-polymers2,9548
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area23720 Å2
ΔGint-127 kcal/mol
Surface area47640 Å2
MethodPISA
2
E: Inosine-5'-monophosphate dehydrogenase
F: Inosine-5'-monophosphate dehydrogenase
G: Inosine-5'-monophosphate dehydrogenase
H: Inosine-5'-monophosphate dehydrogenase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)165,79212
Polymers162,8384
Non-polymers2,9548
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area23760 Å2
ΔGint-125 kcal/mol
Surface area47090 Å2
MethodPISA
Unit cell
Length a, b, c (Å)83.220, 89.391, 103.987
Angle α, β, γ (deg.)81.13, 89.95, 83.59
Int Tables number1
Space group name H-MP1

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Components

#1: Protein
Inosine-5'-monophosphate dehydrogenase / IMP dehydrogenase / IMPD / IMPDH


Mass: 40709.574 Da / Num. of mol.: 8 / Fragment: IMPDH-delta-L-CBS / Mutation: CBS domain (residues 92-220) is replaced with GG
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Bacillus anthracis (anthrax bacterium) / Strain: Ames / Gene: BAS0011, BA_0008, GBAA_0008, guaB / Plasmid: pMCSG7 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21 magic
References: UniProt: Q81W29, UniProt: A0A6L8P2U9*PLUS, IMP dehydrogenase
#2: Chemical
ChemComp-IMP / INOSINIC ACID / Inosinic acid


Mass: 348.206 Da / Num. of mol.: 8 / Source method: obtained synthetically / Formula: C10H13N4O8P
#3: Chemical
ChemComp-P68 / 1-(4-bromophenyl)-3-(2-{3-[(1E)-N-hydroxyethanimidoyl]phenyl}propan-2-yl)urea


Mass: 390.274 Da / Num. of mol.: 8 / Source method: obtained synthetically / Formula: C18H20BrN3O2
#4: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 117 / 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: 2.33 Å3/Da / Density % sol: 47.25 %
Crystal growTemperature: 289 K / Method: vapor diffusion, sitting drop / pH: 7
Details: 0.1 M succinic acid pH 7.0, 15% w/v PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 289K

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: APS / Beamline: 19-ID / Wavelength: 0.97926 Å
DetectorType: ADSC QUANTUM 315r / Detector: CCD / Date: Jun 18, 2012 / Details: mirrors
RadiationMonochromator: double crystal monochromator / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97926 Å / Relative weight: 1
ReflectionResolution: 2.5997→50 Å / Num. all: 88256 / Num. obs: 88256 / % possible obs: 97.8 % / Observed criterion σ(F): 0 / Observed criterion σ(I): 0 / Redundancy: 2.2 % / Biso Wilson estimate: 45.76 Å2 / Rsym value: 0.09 / Net I/σ(I): 8.4
Reflection shellResolution: 2.5997→2.64 Å / Redundancy: 2.2 % / Mean I/σ(I) obs: 2.1 / Num. unique all: 4394 / Rsym value: 0.426 / % possible all: 97.8

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Processing

Software
NameVersionClassification
SBC-Collectdata collection
HKL-3000data collection
HKL-3000phasing
MOLREPphasing
PHENIX(phenix.refine: 1.8.1_1161)refinement
HKL-3000data reduction
HKL-3000data scaling
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: PDBID ENTRY 3TSD

3tsd


Resolution: 2.5997→36.254 Å / SU ML: 0.36 / Isotropic thermal model: mixed / Cross valid method: THROUGHOUT / σ(F): 1.96 / Phase error: 28 / Stereochemistry target values: ML
RfactorNum. reflection% reflectionSelection details
Rfree0.253 4415 5.01 %random
Rwork0.194 ---
all0.197 88200 --
obs0.197 88200 97.5 %-
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 60.5 Å2
Refinement stepCycle: LAST / Resolution: 2.5997→36.254 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms20517 0 376 117 21010
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.00921209
X-RAY DIFFRACTIONf_angle_d1.20828717
X-RAY DIFFRACTIONf_dihedral_angle_d17.7097719
X-RAY DIFFRACTIONf_chiral_restr0.0753338
X-RAY DIFFRACTIONf_plane_restr0.0053692
LS refinement shell

Refine-ID: X-RAY DIFFRACTION

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection obs% reflection obs (%)
2.5997-2.62920.34891490.28182558270791
2.6292-2.66010.3291520.28192759291197
2.6601-2.69260.36431260.2942782290895
2.6926-2.72660.33741620.26862805296898
2.7266-2.76250.36231740.26162754292898
2.7625-2.80030.30751560.23982851300798
2.8003-2.84030.36171420.2372758290098
2.8403-2.88270.27061330.23232911304498
2.8827-2.92770.33351430.22992734287798
2.9277-2.97570.28961400.23312892303298
2.9757-3.0270.28521570.23262769292698
3.027-3.0820.30711700.22352837300798
3.082-3.14130.30941270.23122800292799
3.1413-3.20530.32021380.23352864301299
3.2053-3.2750.31671660.22362788295498
3.275-3.35110.27191420.21172831297398
3.3511-3.43490.28271430.20972772291597
3.4349-3.52770.24431280.20972785291397
3.5277-3.63140.30071460.2062847299398
3.6314-3.74850.24531550.19632745290097
3.7485-3.88230.25591560.19222803295898
3.8823-4.03750.25711400.17882787292797
4.0375-4.2210.21441590.16422771293098
4.221-4.44320.21361310.16722844297598
4.4432-4.7210.20921430.15962821296498
4.721-5.08460.22211530.15632763291697
5.0846-5.59470.20611690.16812800296998
5.5947-6.40040.20841570.17462816297398
6.4004-8.04920.17941190.15312817293698
8.0492-36.25740.19511390.15492721286095
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)
10.55890.1855-0.16531.77630.17320.6946-0.1248-0.00060.0493-0.10020.1689-0.2332-0.11890.1097-0.06040.47590.0374-0.06710.5278-0.00810.392519.0518-4.480914.5014
23.2707-0.04540.77832.344-0.25772.2055-0.16680.0594-0.30940.15130.1846-0.24190.42670.6594-0.00950.49540.1404-0.02370.6527-0.03440.507736.8846-20.71589.8361
33.3693-0.32970.390.2020.52660.8565-0.3299-0.337-0.46360.17980.0603-0.08710.24080.37620.27580.46120.07090.00660.50960.11920.488325.1157-24.671619.5416
42.2020.27310.59051.24020.06491.8241-0.18370.1129-0.0684-0.03040.0708-0.099-0.05680.32740.1040.34950.0049-0.01970.4508-0.00320.359621.0072-11.462110.1018
51.121-0.6233-0.1442.50290.7041.484-0.19030.17430.0132-0.03980.20090.03020.08850.2722-00.29550.0004-0.01020.45250.02260.391224.7048-8.68291.1945
62.2770.5294-0.04841.0026-0.17950.887-0.01390.02770.1104-0.0169-0.05780.02210.10820.1760.06530.5218-0.0104-0.07350.5098-0.07130.497116.40156.71556.1607
70.7232-0.23010.17140.71830.0011.51340.0899-0.08160.23730.04820.0112-0.0876-0.40780.1825-0.10560.4628-0.01980.02560.3729-0.07580.45189.349828.07281.5335
80.56740.1777-0.11941.4567-0.42420.14890.0763-0.12140.10230.17450.0265-0.1837-0.30480.2268-0.09680.5975-0.06420.01260.4544-0.07490.472414.481426.71448.3191
91.5773-0.4339-0.2060.7143-0.18792.04490.22690.37080.1725-0.1256-0.1410.01-0.20340.2309-0.07820.5043-0.03740.01110.332-0.02270.450713.693621.9128-11.0093
102.2728-0.75650.76292.2864-0.21051.80240.0220.0606-0.1164-0.18260.1089-0.2804-0.47730.2255-0.08180.521-0.02080.07410.39170.01480.4337-5.930317.3188-3.4412
111.4775-1.17871.51582.9276-0.99142.3106-0.1557-0.03430.15060.28190.13970.1771-0.1095-0.68840.08790.4159-0.0570.05590.50420.00050.3983-17.2222-4.51659.8713
121.46190.677-0.01281.6192-0.29463.47740.0261-0.0956-0.22250.0448-0.1886-0.12170.60.24330.14760.3720.01740.0430.33850.01190.4342-2.8066-32.87363.842
132.40830.74810.20762.88540.43192.9539-0.0470.3083-0.3234-0.27240.08530.18980.4308-0.4046-0.01740.4985-0.1025-0.06120.42780.01490.497-16.7015-38.0211-10.8439
141.3795-0.5984-0.23141.96320.95572.1663-0.15630.382-0.3170.1034-0.0180.42060.0853-0.740.16230.4512-0.08050.03530.7160.06210.614-26.2454-29.9239-1.3155
150.7529-0.7082-0.06540.80190.13441.2011-0.08660.0952-0.12280.11510.05430.15910.236-0.25890.03840.3688-0.07310.0130.38990.03460.4414-14.1874-22.51353.4602
164.0155-0.7854-0.56893.82851.49012.70590.1990.78660.0311-0.9647-0.0081-0.5745-0.70920.3156-0.25440.5759-0.06080.08290.5831-0.03030.4339-0.8996-25.0449-18.9475
171.2094-1.78790.80291.9185-0.23261.12540.10140.2432-0.182-0.0829-0.11490.138-0.01140.14890.01130.3879-0.07120.00660.38150.08140.4527-4.8099-23.976-10.4079
181.8318-0.42870.13541.17370.33373.0523-0.13230.0996-0.0657-0.0503-0.0071-0.1089-0.12440.14060.15860.3929-0.0264-0.02360.4155-0.00470.42176.0966-17.83424.4292
191.56220.8754-0.41850.401-0.09980.20350.0754-0.19830.0024-0.0631-0.13040.0951-0.0988-0.30810.04950.41660.0425-0.08130.49150.00510.43-21.60642.7211.5832
201.3867-0.4946-0.1153.48710.21010.740.21420.3920.088-0.7093-0.22430.3265-0.2717-0.35750.0210.59230.1006-0.1250.65150.07190.5187-30.111715.1383-20.8406
211.00430.32670.00441.7157-0.63441.61040.56420.48160.1773-0.385-0.16930.0769-0.4687-0.2361-0.4910.65260.22080.07350.63130.11590.7627-30.474124.3908-13.1099
221.43910.43340.3981.124-0.74451.2708-0.0346-0.04090.150.05120.08130.231-0.352-0.2653-0.03890.42980.08120.00070.45450.02540.5107-24.057214.2574-3.9174
234.42221.64341.71892.64221.56333.28780.15530.5146-0.2497-0.18510.0847-0.4517-0.38890.0496-0.27880.4778-0.02180.05350.56950.01370.4929-12.647711.7224-24.8608
240.5576-0.52840.771.2152-0.74022.8445-0.08690.22540.0480.04870.024-0.01270.04080.01840.07110.3912-0.0517-0.00210.4540.00570.4978-19.0787-6.8018-7.9526
250.808-0.5167-0.44621.1807-0.04590.8782-0.01290.0379-0.01470.0112-0.1389-0.31710.11930.24620.13550.47790.0315-0.05140.7390.02470.580564.52181.063345.6614
261.02451.0096-0.30141.38620.86921.27-0.3464-0.0326-0.6012-0.2187-0.0288-0.7550.82260.60510.39890.82160.21650.11940.75560.09480.836872.1815-16.475240.898
271.58150.18810.39241.2191-0.13620.5334-0.1173-0.16740.26710.0425-0.2046-0.73320.53890.43820.26730.55940.19980.00250.8380.08650.707670.6346-13.270755.7648
281.817-0.00610.00291.3177-0.5070.1132-0.2662-0.1650.2152-0.022-0.0907-0.3950.13170.32740.37950.36910.0225-0.09690.6063-0.01910.540761.0244-0.485550.8596
293.25820.9211-0.51472.22450.05981.6133-0.09850.5489-0.2067-0.24530.0456-0.15990.0981-0.02730.08860.58510.04860.06430.57210.02270.520253.4085-7.565531.0586
304.34760.378-0.58045.38110.55937.0419-0.6432-0.26910.246-1.0698-0.34840.1313-0.60341.16830.98480.38050.0276-0.0720.68010.04890.519865.458511.507136.1649
310.5413-0.2331-0.17461.61531.05643.2309-0.0710.2610.074-0.0733-0.0828-0.0808-0.08420.14510.17250.4275-0.0727-0.05320.5790.050.530955.988814.997343.7565
320.4686-1.2721-0.313.8824-1.40942.6455-0.1287-0.89440.6693-0.23790.2589-1.1375-0.06540.2136-0.09270.5416-0.0682-0.09320.7983-0.08480.737162.189914.972561.3712
331.07180.6308-0.44352.1584-1.26232.48550.13010.02040.2280.0298-0.0936-0.1439-0.35670.3507-0.00790.4758-0.0643-0.00240.4691-0.03530.47443.74539.879241.0483
342.89070.9359-0.89581.5094-0.72034.3873-0.23160.39180.4418-0.19310.5065-0.1174-0.84380.3419-0.1950.8255-0.2260.1120.71290.06480.756359.313844.439628.836
350.12810.11890.07133.0951-1.14950.5773-0.12920.07960.06550.35250.0932-0.6012-0.42920.40870.00610.5427-0.1811-0.09620.7221-0.04970.705365.306838.279340.9755
360.54820.2941-0.10591.7833-0.01530.27480.1082-0.04040.05190.2038-0.0946-0.2721-0.10570.16420.00040.4675-0.1445-0.05390.576-0.04880.537253.365132.307347.6942
374.7923-1.74170.69443.796-1.47451.45640.10930.41140.0862-0.7726-0.1168-0.27810.32150.312-0.00260.5985-0.02240.02660.57710.02120.441945.209725.900726.7144
381.98280.501-2.50271.5638-0.7473.5541-0.12240.2546-0.369-0.2055-0.034-0.09370.5329-0.54520.11380.5186-0.0396-0.0420.4748-0.01970.486933.313837.974943.8234
392.5653-0.551-0.52531.3535-0.67410.69630.02010.2108-0.0047-0.05570.1415-0.2508-0.0777-0.023-0.16440.54350.02710.00770.5234-0.03480.441333.249727.408649.8064
400.2724-0.02020.31481.1528-0.21231.2270.0744-0.2011-0.16010.3455-0.04880.09530.21-0.0254-0.0090.52610.00980.01860.45370.0490.46728.133-18.941261.8665
411.1306-0.155-0.13881.2685-0.15920.416-0.0484-0.3336-0.14990.3747-0.04660.05870.1746-0.00890.08980.6302-0.0180.00930.52290.06890.39827.6839-11.918367.383
420.51220.2369-0.45572.9332-0.33211.55820.01180.0508-0.06510.1420.0560.20150.1995-0.2098-0.08250.4903-0.0737-0.03490.47280.01760.456821.2204-13.350444.8898
432.5974-0.8532-0.49772.33530.38081.3862-0.1459-0.058-0.07620.27670.2184-0.03230.3250.1047-0.09590.53350.0184-0.00690.44290.01910.428445.2501-11.491652.8831
440.9514-0.127-0.21891.2712-0.38531.6574-0.1134-0.1976-0.04910.26620.0184-0.03420.06330.00770.08050.6010.0327-0.04750.5491-0.01530.34228.130514.766765.8872
452.6266-0.5003-1.60432.17220.50043.4574-0.24860.10950.07350.08190.04190.4888-0.2285-1.12790.2380.49460.0467-0.01480.7844-0.01310.59993.617925.624855.4774
463.2707-1.08590.70954.53491.17323.62620.0945-0.13060.9651-0.3016-0.46610.2062-0.7217-0.71760.29680.67470.19380.01840.6863-0.02260.61944.920537.223457.4739
474.1652-0.1191-0.70390.4923-0.62841.0335-0.34990.06830.30570.05170.25880.1709-0.2268-0.03320.04870.6191-0.0030.09020.4989-0.05710.517114.029838.229562.4283
481.107-0.9344-0.70991.54-0.37660.8570.02950.03230.1470.1783-0.0420.1242-0.1414-0.08030.0110.41280.0243-0.0060.4464-0.00480.343620.563324.475762.0558
493.93340.48961.0132.0529-0.34523.6637-0.39410.15410.1404-0.34590.09370.42720.0722-0.27110.27880.5048-0.0438-0.02830.7168-0.03970.490713.856821.488439.8758
503.015-0.81810.19852.59680.80461.10220.0317-0.19260.12570.4909-0.09650.26510.5002-0.09130.0350.5026-0.05640.05170.5220.0070.376618.94817.402764.1341
510.9962-0.9038-1.36723.19421.51161.97140.08020.2616-0.0079-0.3614-0.3580.06610.04720.11580.30940.7379-0.0283-0.01560.85760.04280.553921.9852-1.262747.0695
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection details
1X-RAY DIFFRACTION1chain 'A' and (resid -2 through 56 )
2X-RAY DIFFRACTION2chain 'A' and (resid 57 through 242 )
3X-RAY DIFFRACTION3chain 'A' and (resid 243 through 270 )
4X-RAY DIFFRACTION4chain 'A' and (resid 271 through 389 )
5X-RAY DIFFRACTION5chain 'A' and (resid 390 through 446 )
6X-RAY DIFFRACTION6chain 'A' and (resid 447 through 486 )
7X-RAY DIFFRACTION7chain 'B' and (resid -2 through 90 )
8X-RAY DIFFRACTION8chain 'B' and (resid 91 through 368 )
9X-RAY DIFFRACTION9chain 'B' and (resid 369 through 445 )
10X-RAY DIFFRACTION10chain 'B' and (resid 446 through 486 )
11X-RAY DIFFRACTION11chain 'C' and (resid -5 through 18 )
12X-RAY DIFFRACTION12chain 'C' and (resid 19 through 56 )
13X-RAY DIFFRACTION13chain 'C' and (resid 57 through 242 )
14X-RAY DIFFRACTION14chain 'C' and (resid 243 through 270 )
15X-RAY DIFFRACTION15chain 'C' and (resid 271 through 363 )
16X-RAY DIFFRACTION16chain 'C' and (resid 364 through 389 )
17X-RAY DIFFRACTION17chain 'C' and (resid 390 through 445 )
18X-RAY DIFFRACTION18chain 'C' and (resid 446 through 486 )
19X-RAY DIFFRACTION19chain 'D' and (resid -1 through 39 )
20X-RAY DIFFRACTION20chain 'D' and (resid 40 through 232 )
21X-RAY DIFFRACTION21chain 'D' and (resid 233 through 257 )
22X-RAY DIFFRACTION22chain 'D' and (resid 258 through 368 )
23X-RAY DIFFRACTION23chain 'D' and (resid 369 through 427 )
24X-RAY DIFFRACTION24chain 'D' and (resid 428 through 486 )
25X-RAY DIFFRACTION25chain 'E' and (resid -2 through 77 )
26X-RAY DIFFRACTION26chain 'E' and (resid 78 through 257 )
27X-RAY DIFFRACTION27chain 'E' and (resid 258 through 292 )
28X-RAY DIFFRACTION28chain 'E' and (resid 293 through 363 )
29X-RAY DIFFRACTION29chain 'E' and (resid 364 through 427 )
30X-RAY DIFFRACTION30chain 'E' and (resid 428 through 445 )
31X-RAY DIFFRACTION31chain 'E' and (resid 446 through 486 )
32X-RAY DIFFRACTION32chain 'F' and (resid -5 through 12 )
33X-RAY DIFFRACTION33chain 'F' and (resid 13 through 77 )
34X-RAY DIFFRACTION34chain 'F' and (resid 78 through 242 )
35X-RAY DIFFRACTION35chain 'F' and (resid 243 through 270 )
36X-RAY DIFFRACTION36chain 'F' and (resid 271 through 363 )
37X-RAY DIFFRACTION37chain 'F' and (resid 364 through 427 )
38X-RAY DIFFRACTION38chain 'F' and (resid 428 through 446 )
39X-RAY DIFFRACTION39chain 'F' and (resid 447 through 486 )
40X-RAY DIFFRACTION40chain 'G' and (resid -1 through 242 )
41X-RAY DIFFRACTION41chain 'G' and (resid 243 through 368 )
42X-RAY DIFFRACTION42chain 'G' and (resid 369 through 427 )
43X-RAY DIFFRACTION43chain 'G' and (resid 428 through 486 )
44X-RAY DIFFRACTION44chain 'H' and (resid -2 through 33 )
45X-RAY DIFFRACTION45chain 'H' and (resid 34 through 91 )
46X-RAY DIFFRACTION46chain 'H' and (resid 92 through 242 )
47X-RAY DIFFRACTION47chain 'H' and (resid 243 through 270 )
48X-RAY DIFFRACTION48chain 'H' and (resid 271 through 368 )
49X-RAY DIFFRACTION49chain 'H' and (resid 369 through 427 )
50X-RAY DIFFRACTION50chain 'H' and (resid 428 through 470 )
51X-RAY DIFFRACTION51chain 'H' and (resid 471 through 486 )

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