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- PDB-6e6i: Crystal structure of 4-methyl HOPDA bound to LigY from Sphingobiu... -

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Basic information

Entry
Database: PDB / ID: 6e6i
TitleCrystal structure of 4-methyl HOPDA bound to LigY from Sphingobium sp. strain SYK-6
Components2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
KeywordsHYDROLASE / C-C hydrolase / amidohydrolase superfamily / meta-cleavage / aromatic compound
Function / homology
Function and homology information


secondary metabolic process / carboxy-lyase activity / hydrolase activity / metal ion binding / cytoplasm
Similarity search - Function
2-amino-3-carboxymuconate-6-semialdehyde decarboxylase / Amidohydrolase / Amidohydrolase-related / Metal-dependent hydrolase
Similarity search - Domain/homology
Chem-HVS / 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
Similarity search - Component
Biological speciesSphingobium sp. SYK-6 (bacteria)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.4 Å
AuthorsKuatsjah, E. / Chan, A.C. / Hurst, T.E. / Snieckus, V. / Murphy, M.E. / Eltis, L.D.
Funding support Canada, 2items
OrganizationGrant numberCountry
Natural Sciences and Engineering Research Council (NSERC, Canada)04802 Canada
Natural Sciences and Engineering Research Council (NSERC, Canada)171359 Canada
CitationJournal: Acs Catalysis / Year: 2018
Title: Metal- and Serine-Dependent Meta-Cleavage Product Hydrolases Utilize Similar Nucleophile-Activation Strategies
Authors: Kuatsjah, E. / Chan, A.C.K. / Hurst, T.E. / Snieckus, V. / Murphy, M.E.P. / Eltis, L.D.
History
DepositionJul 24, 2018Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jan 30, 2019Provider: repository / Type: Initial release
Revision 1.1Jan 8, 2020Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.2Oct 11, 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_conn
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_conn.pdbx_dist_value / _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

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
B: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
C: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
D: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
E: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
F: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
G: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
H: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
I: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)338,58927
Polymers335,9209
Non-polymers2,67018
Water11,349630
1
A: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
F: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
G: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
hetero molecules

A: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
F: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
G: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)225,72618
Polymers223,9476
Non-polymers1,78012
Water1086
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation3_554-x,y,-z-1/21
Buried area19660 Å2
ΔGint-70 kcal/mol
Surface area62970 Å2
MethodPISA
2
B: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
C: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
D: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
E: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
H: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
I: 2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)225,72618
Polymers223,9476
Non-polymers1,78012
Water1086
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area19640 Å2
ΔGint-72 kcal/mol
Surface area62660 Å2
MethodPISA
Unit cell
Length a, b, c (Å)180.645, 195.099, 179.917
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number20
Space group name H-MC2221
Components on special symmetry positions
IDModelComponents
11A-563-

HOH

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Components

#1: Protein
2,2',3-trihydroxy-3'-methoxy-5,5'-dicarboxybiphenyl meta-cleavage compound hydrolase / LigY


Mass: 37324.418 Da / Num. of mol.: 9
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Sphingobium sp. SYK-6 (bacteria) / Gene: ligY, SLG_07750 / Plasmid: pET41b / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: G2IN02
#2: Chemical
ChemComp-ZN / ZINC ION


Mass: 65.409 Da / Num. of mol.: 9 / Source method: obtained synthetically / Formula: Zn
#3: Chemical
ChemComp-HVS / (1Z,3E)-5-carboxy-3-methyl-5-oxo-1-phenylpenta-1,3-dien-1-olate


Mass: 231.224 Da / Num. of mol.: 9 / Source method: obtained synthetically / Formula: C13H11O4 / Feature type: SUBJECT OF INVESTIGATION
#4: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 630 / 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: 2.36 Å3/Da / Density % sol: 47.87 %
Crystal growTemperature: 298 K / Method: vapor diffusion, sitting drop / pH: 7.5 / Details: 0.1 M Tris-Cl, 0.2 M lithium sulfate, 24% PEG4000

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: SSRL / Beamline: BL9-2 / Wavelength: 0.97896 Å
DetectorType: DECTRIS PILATUS 6M / Detector: PIXEL / Date: Jan 15, 2018
RadiationMonochromator: double crystal Si(111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97896 Å / Relative weight: 1
ReflectionResolution: 2.4→38.14 Å / Num. obs: 122972 / % possible obs: 96.6 % / Redundancy: 3.38 % / Biso Wilson estimate: 38.89 Å2 / CC1/2: 0.996 / Rmerge(I) obs: 0.108 / Rrim(I) all: 0.128 / Χ2: 1.12 / Net I/σ(I): 7.84
Reflection shell

Diffraction-ID: 1

Resolution (Å)Redundancy (%)Rmerge(I) obsMean I/σ(I) obsNum. unique obsCC1/2Rrim(I) all% possible all
2.4-2.473.0650.6941.51135680.6680.83674.7
2.47-2.533.2120.6151.85170320.7390.7495.6
2.53-2.613.5860.5022.39170700.810.59299.2
2.61-2.693.6090.432.81166020.8510.50699.1
2.69-2.783.5810.3583.38159990.9010.42398.7
2.78-2.873.5750.3083.95155270.9280.36398.9
2.87-2.983.5530.2554.79149980.9520.30198.7
2.98-3.13.4750.2026.03144320.9670.23899.1
3.1-3.243.2430.1627.17136960.9760.19397.6
3.24-3.43.3130.1358.46130400.9850.1697.8
3.4-3.583.4510.10511.03127380.990.12599.5
3.58-3.83.3670.08712.59119230.9930.10399
3.8-4.063.270.07413.99112440.9950.08899
4.06-4.393.180.06215.37104020.9950.07498.8
4.39-4.812.9370.05315.4993410.9970.06496
4.81-5.373.2930.05615.8487110.9970.06798.8
5.37-6.213.4440.05815.0677240.9970.06999.5
6.21-7.63.3940.05414.7665420.9970.06499.3
7.6-10.753.1160.03917.7849440.9980.04796.6
10.75-38.143.5810.03319.2527820.9990.03897.5

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Processing

Software
NameVersionClassification
PHENIXrefinement
XDSdata reduction
XSCALEdata scaling
PDB_EXTRACT3.24data extraction
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: PDB entry 5VN5

5vn5


Resolution: 2.4→38.14 Å / SU ML: 0.27 / Cross valid method: THROUGHOUT / σ(F): 1.34 / Phase error: 24.5
RfactorNum. reflection% reflection
Rfree0.2193 2003 1.63 %
Rwork0.1827 --
obs0.1833 122813 99.41 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Displacement parametersBiso max: 140.27 Å2 / Biso mean: 51.6619 Å2 / Biso min: 22.93 Å2
Refinement stepCycle: final / Resolution: 2.4→38.14 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms23579 0 252 630 24461
Biso mean--57.65 43.36 -
Num. residues----2985
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 14

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
2.4-2.460.2891320.25378342847497
2.46-2.52650.29661340.24688505863999
2.5265-2.60090.24481510.226685798730100
2.6009-2.68480.33971430.225185808723100
2.6848-2.78070.25291430.218985838726100
2.7807-2.8920.26721370.223186158752100
2.892-3.02360.25961500.225286338783100
3.0236-3.18290.23981420.205686258767100
3.1829-3.38220.25471430.203586408783100
3.3822-3.64320.19831360.179286818817100
3.6432-4.00940.19481460.157986978843100
4.0094-4.58880.16571480.135187188866100
4.5888-5.77820.17631490.142187628911100
5.7782-38.1450.20951490.17368850899998
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)
11.04380.0254-0.52165.9464-0.24950.89170.0144-0.11040.06060.3376-0.07010.38450.2472-0.1220.05160.49290.0004-0.03040.38530.01240.2506-2.662286.52-18.3046
21.192-0.12620.17931.53380.32782.769-0.00160.02070.0245-0.0167-0.0284-0.16160.30430.15550.03330.33220.0182-0.0010.29840.01410.27929.698489.1908-29.6386
33.89990.23211.07162.30081.6993.55280.1260.329-0.0662-0.0838-0.0413-0.23430.75450.27950.0110.63490.14110.04140.32130.00970.32729.287774.4876-44.4543
43.36090.7006-0.33663.0570.05430.6728-0.09070.0614-0.42-0.324-0.0341-0.2090.6783-0.00080.10610.74610.00780.05010.37240.09210.35183.362667.7572-28.6619
50.83240.77520.02758.31810.1091.9901-0.11590.1420.1183-0.44920.0792-0.4555-0.0880.02620.03410.2226-0.0423-0.00140.2730.01610.261265.435589.7656-73.698
61.6291-0.0075-0.26461.11410.23042.0303-0.0873-0.10650.18110.05130.02060.09980.0179-0.18950.07510.2345-0.0048-0.0130.2932-0.01120.266753.699488.275-61.8028
72.71331.1563-1.08422.4451-0.19925.1062-0.0498-0.1955-0.05320.36530.00030.09050.5378-0.3490.110.39390.00120.01150.31440.03750.25154.765874.3873-49.3279
85.9838-0.5071-1.00097.8233-0.98751.9418-0.1164-0.2548-0.728-0.16030.02210.00030.5186-0.09310.03750.433-0.04060.05550.24-0.04940.14657.370266.3838-62.0498
91.2606-0.7401-0.43672.5789-0.38270.8533-0.1636-0.15550.20320.90150.16660.03820.49780.3288-0.01250.65370.1799-0.12480.5563-0.06990.32759.152493.7519-17.5088
100.79750.3275-0.2681.6770.16352.6844-0.2853-0.1522-0.00270.77140.30860.07560.90940.1073-0.03510.84670.2147-0.0250.5111-0.03590.359656.580882.3799-18.6501
110.7968-0.3366-0.82621.38750.80682.3896-0.2593-0.27590.34010.44190.3996-0.43560.4690.5211-0.10.46690.1995-0.17110.6202-0.15050.381270.343989.8958-29.3474
122.4239-0.70881.37464.01431.43566.24850.0727-0.19870.39070.00710.3958-0.47590.36881.0785-0.34860.40970.1622-0.02880.5394-0.11290.417874.586978.2566-49.0882
130.0675-0.40340.02762.10890.26173.5196-0.3201-0.1729-0.19660.72070.231-0.09781.29810.3685-0.02980.8670.2123-0.00720.44650.00280.349364.178169.0985-30.7786
143.0541-1.8671-1.03555.48091.69380.6177-0.1248-0.1487-0.13720.3656-0.08960.24170.3479-0.08530.12640.40920.0119-0.02880.4733-0.05650.270843.312599.7491-19.2166
152.13040.0896-0.72721.68360.61693.6395-0.052-0.34150.11450.323-0.08130.21010.2059-0.05610.12660.37810.0617-0.00310.4599-0.08640.334640.7747103.6509-13.741
161.6062-0.0075-0.16282.1252-0.24581.1394-0.027-0.03620.23280.007-0.03470.17850.0776-0.01760.05150.28920.0556-0.06310.4153-0.1350.407438.2879116.748-26.3867
172.15950.2875-0.064.4089-0.62470.97290.0156-0.2260.54760.0732-0.06920.4156-0.201-0.17010.00960.29130.0896-0.03530.4322-0.21510.581140.3926133.7489-18.5497
182.0203-1.50750.72163.486-0.01013.657-0.2281-0.56660.44030.58050.06910.2131-0.2901-0.19540.15840.43540.01930.04820.5653-0.22760.494636.558122.2396-4.9164
191.61771.3049-1.32213.7127-2.55324.1496-0.08940.05020.034-0.15840.1092-0.01320.3333-0.052-0.03680.22770.015-0.05180.2769-0.00830.302978.5436100.5608-75.769
201.154-0.14670.03721.6735-0.02781.5345-0.0525-0.11640.2380.05650.0502-0.1495-0.07340.1236-0.00590.2182-0.0277-0.0680.32110.02370.427182.3491114.2662-66.2905
215.8027-1.4212-0.14453.0783-0.97081.51180.1143-0.31611.19140.21650.1344-0.6993-0.65080.2475-0.23290.4431-0.11270.04120.3151-0.07380.740479.1741138.3405-65.4886
225.8585-0.58722.35682.90052.17074.21970.17910.08180.2747-0.35780.1868-0.1196-0.5791-0.0036-0.29790.3638-0.05580.04040.32450.09260.477179.7468129.3686-79.7462
234.12251.0741.82932.79970.97624.3477-0.02090.20350.4915-0.40450.117-0.3796-0.43210.3982-0.11690.3261-0.03310.09950.29770.0670.44984.3928123.3132-85.0506
241.33661.0634-1.58792.2707-1.91994.3222-0.12880.3044-0.0578-0.39840.0819-0.0660.4753-0.09760.05370.35150.06210.00080.5233-0.03970.289317.6701102.5966-76.2837
252.17280.06330.07192.07040.25941.5893-0.0720.03410.08180.01080.0782-0.20560.09670.3252-0.02240.21360.0146-0.020.3750.00840.253222.0001113.9626-64.4555
268.7889-3.02662.01687.2101-1.27413.88980.0703-0.06431.07890.6583-0.1724-0.5394-0.21910.36460.0710.2937-0.11450.02450.4150.09040.482519.2015137.2167-65.6879
272.42071.02550.23313.11721.23791.945-0.11450.35390.2412-0.58580.1389-0.1809-0.09320.2204-0.02420.3861-0.03810.04890.54840.08740.314222.1111123.7637-84.0902
280.7306-0.3482-0.51381.47930.90893.12490.2713-0.0760.3912-0.22980.0829-0.0981-0.93240.1099-0.34630.5195-0.070.11940.3448-0.12440.64942.6328147.8846-33.9542
291.77490.459-0.42511.0720.11342.82120.0893-0.18230.25350.03570.1954-0.3009-0.14670.5103-0.23560.22530.0153-0.02690.3994-0.16630.50467.6443133.4773-25.9598
303.46871.04310.45894.13-2.134.4680.0051-0.57450.0280.62350.0277-0.30520.1770.1060.00750.29710.0224-0.0610.4412-0.1040.2534-2.6887129.0968-9.3666
311.66280.24121.2934.3415-0.24572.70870.0111-0.48540.55690.3321-0.04990.2788-0.3051-0.37950.0230.44690.00760.08610.4498-0.21670.5898-8.3572147.0584-13.959
321.9681-2.07160.87125.58533.13986.87140.173-0.47190.53310.25510.0008-0.5308-0.91810.7823-0.57160.6239-0.1432-0.12990.622-0.32090.73266.5291146.8402-9.2077
330.7865-0.2912-0.83581.4575-0.6135.50780.31140.08570.3077-0.07120.1508-0.033-0.5728-0.3585-0.46630.37330.11770.07350.36370.07480.583653.6856145.15-51.8639
340.98460.2795-0.43842.3888-0.8192.29690.51980.0170.41080.028-0.1394-0.0156-1.0883-0.1019-0.29990.7570.10850.13910.33070.07430.754759.359150.5114-59.8693
351.4443-0.0131-0.37521.06060.62862.56170.16030.12980.2114-0.05350.08540.0798-0.1643-0.5171-0.21410.24330.0664-0.02220.41970.13410.461251.766133.8449-63.9464
361.6313-0.8957-0.57863.93771.59823.65690.16860.34540.4709-0.3942-0.0418-0.1011-0.5475-0.254-0.10370.40210.0392-0.0070.3750.140.439364.3051133.5668-78.3017
371.2174-2.04730.04494.9225-0.38178.33250.4350.27280.5512-0.3140.0064-0.5384-1.11820.4063-0.37430.8309-0.00890.22360.3660.1240.763670.8597149.6413-78.7952
380.49430.34971.15943.684-1.18713.8897-0.13840.44660.5354-0.42140.06980.2461-0.0864-0.4904-0.01480.75750.2430.02470.61270.35160.730553.4704146.969-81.2027
391.52360.4827-0.34332.37521.0852.2975-0.07590.04210.4307-0.17860.1691-0.3308-0.44560.3506-0.02260.32370.0413-0.00830.3483-0.09050.574464.8512145.9747-39.0571
402.5519-1.7908-1.08493.82242.32192.79270.1447-0.02410.298-0.0654-0.17060.1307-0.4659-0.08280.03710.3675-0.0035-0.05220.3421-0.090.543658.6334150.9569-30.9168
411.74830.98590.11691.8234-0.73681.51630.0785-0.15970.2862-0.0718-0.0164-0.1585-0.11540.3308-0.06350.219-0.004-0.02590.3968-0.10980.568369.7793144.5086-33.4196
420.76220.6446-0.02942.5360.21131.6753-0.02-0.1862-0.14480.00710.0554-0.48960.09390.3029-0.03490.22770.0832-0.05460.4481-0.1280.528272.0226132.0392-27.0073
430.27050.96560.37443.43130.70982.75790.1418-0.04990.3222-0.0106-0.03730.15080.1481-0.0205-0.21070.25460.0844-0.04720.3715-0.08150.411359.9257133.3075-27.8855
440.64270.7874-0.5523.1917-0.01241.9441-0.0087-0.14070.2280.06590.01730.00590.01650.0512-0.01130.26110.0536-0.10230.4379-0.10590.349362.6919129.8971-18.6718
452.67343.2614-2.70587.0709-1.67373.57520.4367-0.6991-0.40990.3254-0.523-0.30260.33640.18230.11790.45510.061-0.17220.5997-0.11070.383258.2938123.2878-8.8505
461.7511-0.80370.30455.0705-2.1451.17270.0367-0.53630.38730.32980.01210.07910.03120.0428-0.0160.35220.0277-0.05480.5282-0.270.577653.5309142.0483-14.5266
471.1573-0.67120.27931.40320.16892.1558-0.1057-0.61160.36220.4793-0.04070.0353-0.1744-0.03660.13150.53110.0063-0.07210.5426-0.34680.65556.4712149.1401-10.9488
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 1 through 82 )A1 - 82
2X-RAY DIFFRACTION2chain 'A' and (resid 83 through 225 )A83 - 225
3X-RAY DIFFRACTION3chain 'A' and (resid 226 through 272 )A226 - 272
4X-RAY DIFFRACTION4chain 'A' and (resid 273 through 332 )A273 - 332
5X-RAY DIFFRACTION5chain 'B' and (resid 1 through 54 )B1 - 54
6X-RAY DIFFRACTION6chain 'B' and (resid 55 through 225 )B55 - 225
7X-RAY DIFFRACTION7chain 'B' and (resid 226 through 291 )B226 - 291
8X-RAY DIFFRACTION8chain 'B' and (resid 292 through 332 )B292 - 332
9X-RAY DIFFRACTION9chain 'C' and (resid 1 through 37 )C1 - 37
10X-RAY DIFFRACTION10chain 'C' and (resid 38 through 82 )C38 - 82
11X-RAY DIFFRACTION11chain 'C' and (resid 83 through 225 )C83 - 225
12X-RAY DIFFRACTION12chain 'C' and (resid 226 through 252 )C226 - 252
13X-RAY DIFFRACTION13chain 'C' and (resid 253 through 332 )C253 - 332
14X-RAY DIFFRACTION14chain 'D' and (resid 1 through 37 )D1 - 37
15X-RAY DIFFRACTION15chain 'D' and (resid 38 through 103 )D38 - 103
16X-RAY DIFFRACTION16chain 'D' and (resid 104 through 225 )D104 - 225
17X-RAY DIFFRACTION17chain 'D' and (resid 226 through 272 )D226 - 272
18X-RAY DIFFRACTION18chain 'D' and (resid 273 through 332 )D273 - 332
19X-RAY DIFFRACTION19chain 'E' and (resid 1 through 54 )E1 - 54
20X-RAY DIFFRACTION20chain 'E' and (resid 55 through 225 )E55 - 225
21X-RAY DIFFRACTION21chain 'E' and (resid 226 through 252 )E226 - 252
22X-RAY DIFFRACTION22chain 'E' and (resid 253 through 272 )E253 - 272
23X-RAY DIFFRACTION23chain 'E' and (resid 273 through 332 )E273 - 332
24X-RAY DIFFRACTION24chain 'F' and (resid 1 through 82 )F1 - 82
25X-RAY DIFFRACTION25chain 'F' and (resid 83 through 225 )F83 - 225
26X-RAY DIFFRACTION26chain 'F' and (resid 226 through 252 )F226 - 252
27X-RAY DIFFRACTION27chain 'F' and (resid 253 through 331 )F253 - 331
28X-RAY DIFFRACTION28chain 'G' and (resid 1 through 82 )G1 - 82
29X-RAY DIFFRACTION29chain 'G' and (resid 83 through 231 )G83 - 231
30X-RAY DIFFRACTION30chain 'G' and (resid 232 through 272 )G232 - 272
31X-RAY DIFFRACTION31chain 'G' and (resid 273 through 312 )G273 - 312
32X-RAY DIFFRACTION32chain 'G' and (resid 313 through 331 )G313 - 331
33X-RAY DIFFRACTION33chain 'H' and (resid 1 through 37 )H1 - 37
34X-RAY DIFFRACTION34chain 'H' and (resid 38 through 82 )H38 - 82
35X-RAY DIFFRACTION35chain 'H' and (resid 83 through 225 )H83 - 225
36X-RAY DIFFRACTION36chain 'H' and (resid 226 through 291 )H226 - 291
37X-RAY DIFFRACTION37chain 'H' and (resid 292 through 312 )H292 - 312
38X-RAY DIFFRACTION38chain 'H' and (resid 313 through 331 )H313 - 331
39X-RAY DIFFRACTION39chain 'I' and (resid 1 through 37 )I1 - 37
40X-RAY DIFFRACTION40chain 'I' and (resid 38 through 82 )I38 - 82
41X-RAY DIFFRACTION41chain 'I' and (resid 83 through 121 )I83 - 121
42X-RAY DIFFRACTION42chain 'I' and (resid 122 through 171 )I122 - 171
43X-RAY DIFFRACTION43chain 'I' and (resid 172 through 189 )I172 - 189
44X-RAY DIFFRACTION44chain 'I' and (resid 190 through 225 )I190 - 225
45X-RAY DIFFRACTION45chain 'I' and (resid 226 through 252 )I226 - 252
46X-RAY DIFFRACTION46chain 'I' and (resid 253 through 291 )I253 - 291
47X-RAY DIFFRACTION47chain 'I' and (resid 292 through 332 )I292 - 332

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