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- PDB-8upp: Campylobacter jejuni ketol-acid reductoisomerase in complex with ... -

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Basic information

Entry
Database: PDB / ID: 8upp
TitleCampylobacter jejuni ketol-acid reductoisomerase in complex with NADPH and Hoe704
ComponentsKetol-acid reductoisomerase
KeywordsOXIDOREDUCTASE / Inhibitor / Biofuel / Enzyme
Function / homology
Function and homology information


ketol-acid reductoisomerase (NADP+) / ketol-acid reductoisomerase activity / valine biosynthetic process / isoleucine biosynthetic process / isomerase activity / NADP binding / magnesium ion binding / cytosol
Similarity search - Function
Ketol-acid reductoisomerase, prokaryotic / Ketol-acid reductoisomerase, C-terminal / Ketol-acid reductoisomerase / Ketol-acid reductoisomerase, N-terminal / Acetohydroxy acid isomeroreductase, catalytic domain / Acetohydroxy acid isomeroreductase, NADPH-binding domain / KARI N-terminal domain profile. / KARI C-terminal domain profile. / 6-phosphogluconate dehydrogenase-like, C-terminal domain superfamily / NAD(P)-binding domain superfamily
Similarity search - Domain/homology
Chem-NDP / : / Ketol-acid reductoisomerase (NADP(+))
Similarity search - Component
Biological speciesCampylobacter jejuni (Campylobacter)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 1.78 Å
AuthorsLin, X. / Lv, Y. / Lonhienne, T. / Guddat, L.W.
Funding support Australia, 1items
OrganizationGrant numberCountry
Australian Research Council (ARC)DP210101802 Australia
CitationJournal: Acs Catalysis / Year: 2024
Title: Mapping of the Reaction Trajectory catalyzed by Class I Ketol-Acid Reductoisomerase
Authors: Lin, X. / Lonhienne, T. / Lv, Y. / Kurz, J. / McGeary, R. / Schenk, G. / Guddat, L.W.
History
DepositionOct 23, 2023Deposition site: RCSB / Processing site: RCSB
Revision 1.0Apr 24, 2024Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
B: Ketol-acid reductoisomerase
H: Ketol-acid reductoisomerase
K: Ketol-acid reductoisomerase
I: Ketol-acid reductoisomerase
D: Ketol-acid reductoisomerase
G: Ketol-acid reductoisomerase
J: Ketol-acid reductoisomerase
E: Ketol-acid reductoisomerase
L: Ketol-acid reductoisomerase
C: Ketol-acid reductoisomerase
F: Ketol-acid reductoisomerase
A: Ketol-acid reductoisomerase
hetero molecules


Theoretical massNumber of molelcules
Total (without water)441,77260
Polymers430,41912
Non-polymers11,35348
Water29,2921626
1


  • Idetical with deposited unit
  • defined by author&software
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area102070 Å2
ΔGint-972 kcal/mol
Surface area125630 Å2
MethodPISA
Unit cell
Length a, b, c (Å)111.947, 111.954, 111.944
Angle α, β, γ (deg.)110.910, 107.730, 109.760
Int Tables number1
Space group name H-MP1
Space group name HallP1
Symmetry operation#1: x,y,z

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Components

#1: Protein
Ketol-acid reductoisomerase


Mass: 35868.223 Da / Num. of mol.: 12
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Campylobacter jejuni (Campylobacter) / Gene: ilvC, CW563_00670 / Production host: Escherichia coli (E. coli)
References: UniProt: A0A5T0UG45, ketol-acid reductoisomerase (NADP+)
#2: Chemical...
ChemComp-MG / MAGNESIUM ION


Mass: 24.305 Da / Num. of mol.: 24 / Source method: obtained synthetically / Formula: Mg
#3: Chemical
ChemComp-NDP / NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE


Mass: 745.421 Da / Num. of mol.: 12 / Source method: obtained synthetically / Formula: C21H30N7O17P3 / Feature type: SUBJECT OF INVESTIGATION
#4: Chemical
ChemComp-X9W / (2R)-(dimethylphosphoryl)(hydroxy)acetic acid


Mass: 152.086 Da / Num. of mol.: 12 / Source method: obtained synthetically / Formula: C4H9O4P / Feature type: SUBJECT OF INVESTIGATION
#5: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 1626 / 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: 2.51 Å3/Da / Density % sol: 50.96 %
Crystal growTemperature: 293 K / Method: vapor diffusion, hanging drop / Details: 0.2 M NH4I, 20% PEG3350

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: Australian Synchrotron / Beamline: MX1 / Wavelength: 1 Å
DetectorType: ADSC QUANTUM 210r / Detector: CCD / Date: May 10, 2020
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1 Å / Relative weight: 1
ReflectionResolution: 1.78→34.35 Å / Num. obs: 372120 / % possible obs: 93.29 % / Redundancy: 12.3 % / Biso Wilson estimate: 19.53 Å2 / CC1/2: 0.765 / Net I/σ(I): 20.3
Reflection shellResolution: 1.78→3.85 Å / Num. unique obs: 31881 / CC1/2: 0.794

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Processing

Software
NameVersionClassification
PHENIX1.20.1_4487refinement
XDSdata reduction
XDSdata scaling
PHENIXphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 1.78→34.35 Å / SU ML: 0.2925 / Cross valid method: FREE R-VALUE / σ(F): 0.09 / Phase error: 33.21
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2
RfactorNum. reflection% reflection
Rfree0.2984 1907 0.51 %
Rwork0.2644 370213 -
obs0.2646 372120 93.29 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.1 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso mean: 25.65 Å2
Refinement stepCycle: LAST / Resolution: 1.78→34.35 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms29916 0 708 1626 32250
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.008731176
X-RAY DIFFRACTIONf_angle_d0.974842180
X-RAY DIFFRACTIONf_chiral_restr0.05694752
X-RAY DIFFRACTIONf_plane_restr0.0075400
X-RAY DIFFRACTIONf_dihedral_angle_d9.17654320
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
1.78-1.830.39391180.328322282X-RAY DIFFRACTION78.57
1.83-1.880.30371260.315523937X-RAY DIFFRACTION84.71
1.88-1.930.41471110.295324887X-RAY DIFFRACTION87.52
1.93-1.990.3211290.292425397X-RAY DIFFRACTION89.61
1.99-2.070.3111290.280726194X-RAY DIFFRACTION92.43
2.07-2.150.29471420.27426763X-RAY DIFFRACTION94.26
2.15-2.250.34781350.271726983X-RAY DIFFRACTION95.25
2.25-2.360.31861430.269827128X-RAY DIFFRACTION95.91
2.36-2.510.30591300.270327379X-RAY DIFFRACTION96.51
2.51-2.710.28621390.264427527X-RAY DIFFRACTION97.06
2.71-2.980.34121450.273827680X-RAY DIFFRACTION97.71
2.98-3.410.31761360.268327960X-RAY DIFFRACTION98.37
3.41-4.290.30321610.240728057X-RAY DIFFRACTION98.95
4.29-34.350.22671630.241928039X-RAY DIFFRACTION99.18
Refinement TLS params.

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

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
10.791927256595-0.142804448912-0.06874520064280.4504991773420.02755503933591.82198768477-0.0456824424034-0.118642378614-0.126241555180.15304880582-0.03842050500020.3586090991780.28149248292-0.7864488829790.1205366644410.184218199327-0.0364010927951-0.004223827794920.47077181608-0.009962697243750.343320770785-45.494-32.311-17.745
20.608137915592-0.5221160428650.6992094034961.94976329419-0.1990900404361.88209565313-0.0806808718880.00664409164063-0.1013320024030.03376572784890.258955586209-0.02150839677070.4599238862120.322146556603-0.04168367900380.376132304399-0.0476581592454-0.01185347037520.26318605178-0.07064736908030.278979992868-33.534-41.57-25.033
31.21215431591-0.1020924091640.3324313143370.826579389839-0.3009227387232.004455666930.0520236238279-0.0297231553752-0.0623022566297-0.2083142348440.006908321348350.1150738151410.152437414999-0.145306934479-0.009059883620270.18979379733-0.0190885135192-0.0346910322650.24940826023-0.0354178148080.219352855347-37.57-28.611-23.993
40.661044078763-0.173959807980.4687283443110.458685716402-0.2970448750061.29036358731-0.02639179860840.0576802940507-0.00194769842460.00716913266647-0.044745443717-0.00227080054030.0266279825782-0.003150887849060.0472337337980.1573672451590.005965075226620.01396481038510.11491310348-0.01751378874760.111030226401-18.75-25.8040.56
52.19550577811-1.26859132399-0.0001627930296192.36461587492-0.2917855429871.33415468834-0.03130937977440.246209678978-0.09290499246160.0274746578164-0.1139516190160.1913535306070.2617863521910.1199280533460.09257641675930.167231466413-0.04233705868510.01282241103110.1859355074290.007496173078260.130023678961-12.995-24.999-21.841
62.165632519514.26370911851-0.6196973469659.16077184128-2.658774411652.83732228506-0.09467763190080.1498994422660.07718269821950.3022972195860.4392122799030.1115164206610.2968515499750.103619959409-0.2452572907860.342759868660.08312754341680.02709808234750.156872411603-0.01892562938960.219437913259-11.041-44.771-4.722
70.752454308817-0.523582379243-0.4848743985170.6736098934390.08884247669260.8523338596930.1515201282620.08856654313380.234320634687-0.290933630450.0482849285377-0.353498640688-0.2841395907490.229642664892-0.1372724271790.347587539442-0.02259053259710.09834382846210.248112761750.05192401432380.28934569174213.34453.233-16.62
81.50443981642-0.1708978935340.675983038731.91546916468-0.113246112421.30640451806-0.300748003942-0.1783823866840.08765742074060.5554967767150.2061756573370.1566129141870.0980589584408-0.0121900452092-0.0258675234120.3710153518930.0375529714623-0.02734654061910.233467700411-0.09919136274580.4126940317988.3757.648-1.243
92.02007007126-0.7007151111510.0845491719881.09589157124-0.3667825621480.9679044299790.00748376263240.05328989648540.293620393311-0.0331807157171-0.06771886651040.0163579286985-0.102050796442-0.0409324743280.04477473016620.2133805073570.01852804210930.004703596012260.1384647622080.008588204015340.2143657739194.03850.554-12.037
100.769394159719-0.05083709827110.1223149068010.679323492843-0.2395416270580.477345218107-0.0226832140748-0.09025175854890.06761891025670.01385187293420.031268696859-0.0994294486363-0.1151646864470.0144365197635-0.008144623427430.1605609811490.01724267771590.006466778277060.121463183874-0.04504648325520.17660696842217.88328.6813.184
111.56927473609-0.6987161343190.2803679887540.604590838714-0.04537864043860.1324216888060.01895554470850.001425618046630.0724135941105-0.01757926767870.04574361243840.03948385948760.001004532425810.0204361741755-0.05291193503780.143274275467-0.005641534287190.01251725865070.1476876831660.0315508748020.1897102902766.17726.5070.732
127.479285142764.016551732751.506885297055.415575097751.077828469921.77020326953-0.1326865723960.02996241975870.2985189562040.05688680125780.1423905420980.2287714566-0.001940153470580.151585725928-0.03364951203250.2630017846730.0522401121104-0.05974499832560.265918582617-0.09526989933330.2336424822519.75537.39618.315
132.35192966212-0.358985979612-0.7359638926430.788494228827-0.07007462940852.2839672492-0.001462525841970.05398816716870.2941503291730.0888031356767-0.0541657810956-0.353061457791-0.244991248772-0.104484311949-0.00254718467190.15343762003-0.0227214517881-0.06003130932750.202646863605-0.001108436540870.37303616426644.46531.8713.734
141.11431306944-0.4532336020180.1314190061831.72200526324-0.1359007980860.8558651062470.0725829587851-0.05276813894330.1302554308040.071246281731-0.0475163812877-0.209142697670.01692571569120.1279186193370.0004762088281610.155495898669-0.00399605351732-0.0267774932630.219548030197-0.01637603196470.20395108697443.35523.98214.381
151.26698108007-0.5983366612410.619775020870.492176298211-0.3948061394830.3818115475720.02269609518040.01583349106440.046761857458-0.0200205726987-0.01995208664410.01711967928210.0171801884230.0277429650051-0.0008657065277590.1357295290990.01197820572520.003937805706720.11412265485-0.01252579028790.15070520120315.25626.5391.505
160.880897901112-0.585917127646-0.02673166600831.32597306923-1.253844335831.543670529450.02333428030070.1438791504170.1025740561450.0944774930186-0.061948306594-0.277375015417-0.193329123575-0.0578280633970.05508282329990.1900404620710.000265524628095-0.01720026653810.17108785628-0.03040591140230.20072738811729.92320.137-7.916
171.645950469690.88051080962-0.2737177743650.7789761209570.1452124252950.9563296737340.375668718601-0.6214666592140.03905388785410.183088405762-0.313055214241-0.142032733104-0.183941795280.181309448444-0.08847052176640.279402330726-0.0497190860072-0.04188627596610.3783044849580.03778157027960.15076321551615.168-11.37354.539
182.726407501360.129352554820.03270466977931.210653755230.4363209743572.06837722258-0.217043879115-0.091180948252-0.4678452147050.1712617731230.09538122482430.1405306342350.4401836122650.144462146120.01455679832290.321719268058-0.00821543921159-0.0198341872440.292316888810.1070814091790.29352537253710.62-27.07150.759
192.323625016580.222166894115-0.4634980261570.8695540440410.1275589786721.344387892980.178458208353-0.328811365022-0.07029242905270.23902525932-0.1274109617210.0844233347899-0.01952842148570.133218249848-0.01880028100330.225231284635-0.0291512891197-0.02448244800760.198923886955-0.0001186170857620.139973562535.855-14.31450.152
200.9961253289380.298879592762-0.7092874320020.59674564789-0.3711620936010.7792780875950.00376528812887-0.0940287026761-0.0893039706590.0261781197670.0223632543837-0.1396761416320.05890659551790.1162637156-0.01181679832570.1185821001120.0308644764961-0.01765668379460.1583385654060.004082955905480.14361805509320.796-14.21221.64
211.731236566280.664426183777-0.7030510780721.030614516970.4666407477630.7993696191380.009219022850670.03145360197930.02258404755480.107252821157-0.02625259573750.02306296647660.0308154259436-0.006935352544620.05409669405710.132388459250.0167734918702-0.0324969698410.1452180563150.0007586905632380.1059526168690.445-14.83926.091
220.3814703214350.434786120630.441824050860.912159090582-0.2097833660811.69539929312-0.4408942258950.187506679651-1.04988058499-0.2579760565060.140985743279-0.4659058476820.6850954403490.4940589966520.2237637192840.3804142632520.04392843795710.1526262455870.3234140595330.03889245744540.60672498921819.27-36.37617.104
231.09720571144-0.2155098807130.9433238981691.16262550659-0.2789339542280.914572702047-0.2750453106480.08853057674220.0082433907767-0.2718250511380.23716389056-0.0804542943892-0.1383779322740.209086350263-0.01554681912750.290340810512-0.07126168126510.07871997673710.2276507028-0.02931192088650.20112331482742.8692.036-37.083
242.003669590650.07094434457531.055220256241.908149745930.02765462517432.148255083960.20135181039-0.0592789141417-0.27448493334-0.1416859941980.385117590949-0.2722696602470.555976599942-0.0898034715561-0.1900526038770.2493322021840.02375249327270.09059351955350.281338947907-0.08479089952730.4272533009849.708-9.802-27.333
252.135124236730.410421879230.2906669394930.9771181241270.1356812606251.486443834030.147334015219-0.0572298073115-0.332993623568-0.07049621979090.064927551988-0.2429069986650.07689445770110.440484158065-0.1814108193440.203283634091-0.01313325553830.007549773742540.2836129408370.002291362565710.2573024964751.411-0.406-20.527
260.908760053484-0.107487083953-0.003367724576930.11903185845-0.1838665156151.35408701471-0.03869492809530.04254610699760.132365015859-0.117164440233-0.0300050363952-0.0836791230504-0.1143247666040.1393920928070.0151592433840.193553831482-0.02580632497980.04795496291320.1818445314420.01204281863310.17709599442941.844.152-27.815
270.5415844447090.4447927448890.2439863216410.801179684535-0.04201512601970.176868577715-0.0398621248791-0.007510608042840.033497788069-0.1592039201870.0141206710478-0.02398768172410.05566934702340.0441536262268-0.004616712458990.1327479513840.007413229742830.007479242732760.1354257569520.00324337035150.11953581114822.526-11.319-21.419
280.95372421571-0.0503106441595-0.1997542239691.59050914753-0.4239398401650.150002153481-0.0006712710623610.327956503303-0.126978831116-0.443208812958-0.0480802307247-0.09087678004840.1153986721850.0447484845157-0.03580006938450.226497521558-0.01669785161810.009410644729830.2285755407010.003098395655660.11000698340317.439-15.194-34.034
290.5967705096010.454932044340.6951005705570.5659034065580.2702229661091.04136098381-0.02757843667970.03663514025440.03565976676790.027611995049-0.00341097585135-0.0396379856495-0.07232334761230.1064530199960.03263320281120.135945327432-0.005913720257250.0301593020140.149837192913-0.03230479767520.12444329611621.245-6.76-14.36
303.01654445649-1.51807826785-1.333826788084.070965582743.026306939996.403355012150.3518055710110.0279159336088-0.419394076463-0.183978456420.0303935412898-0.4676765255930.1695459540980.655977979877-0.3734895667780.1337527421020.0281648997005-0.02610053662660.203038222880.003294490349580.29018588627327.566-29.496-20.725
311.3989877521-0.4904382808660.3445989958421.50991279518-0.7757378051010.7522903776030.082243585267-0.2699551747030.0885375923161-0.06962934129550.1656627450320.00423075213577-0.083262803081-0.167350080335-0.1158519424860.2588231955040.009664704612560.06698895664540.188822009918-0.07648162365450.247324641851-21.88340.58335.3
320.734486202126-0.1178285025140.1250535208490.511877978175-0.0857266925140.732823528486-0.0333601407518-0.1653853683910.2437677414450.07696282658540.0371047124699-0.0017310289-0.192593095845-0.0293413597473-0.01010390760470.1696289506650.0257944425517-0.002500181017040.15293345059-0.05164371903210.209886443265-16.60239.32627.895
330.4729792235480.0414201542939-0.0971193071460.9486941759420.130032375960.09964262559310.0309041604185-0.05387452432220.01964656816630.06910544675270.0042038717175-0.00455876174453-0.01853037554-0.00711593947039-0.02836052107380.1368888790460.0176329317178-0.009983288192970.157503128710.004491919158740.140406521631-20.757.58823.966
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531.32768167989-0.134276694210.08061213014461.646491236110.1304491084310.792014125920.137516627130.2210487166150.01529825837760.0210751057037-0.1358881354870.313768557455-0.0270123273371-0.184840003686-0.00045988591710.148072132130.0160035928992-0.01016413921940.204478793871-0.008631250821780.232074635195-38.84725.029-14.677
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Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1( CHAIN B AND RESID 3:27 )B3 - 27
2X-RAY DIFFRACTION2( CHAIN B AND RESID 28:60 )B28 - 60
3X-RAY DIFFRACTION3( CHAIN B AND RESID 61:184 )B61 - 184
4X-RAY DIFFRACTION4( CHAIN B AND RESID 185:284 )B185 - 284
5X-RAY DIFFRACTION5( CHAIN B AND RESID 285:313 )B285 - 313
6X-RAY DIFFRACTION6( CHAIN B AND RESID 314:329 )B314 - 329
7X-RAY DIFFRACTION7( CHAIN H AND RESID 3:27 )H3 - 27
8X-RAY DIFFRACTION8( CHAIN H AND RESID 28:60 )H28 - 60
9X-RAY DIFFRACTION9( CHAIN H AND RESID 61:184 )H61 - 184
10X-RAY DIFFRACTION10( CHAIN H AND RESID 185:251 )H185 - 251
11X-RAY DIFFRACTION11( CHAIN H AND RESID 252:313 )H252 - 313
12X-RAY DIFFRACTION12( CHAIN H AND RESID 314:329 )H314 - 329
13X-RAY DIFFRACTION13( CHAIN K AND RESID 3:53 )K3 - 53
14X-RAY DIFFRACTION14( CHAIN K AND RESID 54:184 )K54 - 184
15X-RAY DIFFRACTION15( CHAIN K AND RESID 185:284 )K185 - 284
16X-RAY DIFFRACTION16( CHAIN K AND RESID 285:329 )K285 - 329
17X-RAY DIFFRACTION17( CHAIN I AND RESID 3:27 )I3 - 27
18X-RAY DIFFRACTION18( CHAIN I AND RESID 28:60 )I28 - 60
19X-RAY DIFFRACTION19( CHAIN I AND RESID 61:184 )I61 - 184
20X-RAY DIFFRACTION20( CHAIN I AND RESID 185:267 )I185 - 267
21X-RAY DIFFRACTION21( CHAIN I AND RESID 268:311 )I268 - 311
22X-RAY DIFFRACTION22( CHAIN I AND RESID 312:329 )I312 - 329
23X-RAY DIFFRACTION23( CHAIN D AND RESID 3:27 )D3 - 27
24X-RAY DIFFRACTION24( CHAIN D AND RESID 28:61 )D28 - 61
25X-RAY DIFFRACTION25( CHAIN D AND RESID 62:94 )D62 - 94
26X-RAY DIFFRACTION26( CHAIN D AND RESID 95:173 )D95 - 173
27X-RAY DIFFRACTION27( CHAIN D AND RESID 174:230 )D174 - 230
28X-RAY DIFFRACTION28( CHAIN D AND RESID 231:251 )D231 - 251
29X-RAY DIFFRACTION29( CHAIN D AND RESID 252:313 )D252 - 313
30X-RAY DIFFRACTION30( CHAIN D AND RESID 314:329 )D314 - 329
31X-RAY DIFFRACTION31( CHAIN G AND RESID 3:52 )G3 - 52
32X-RAY DIFFRACTION32( CHAIN G AND RESID 53:201 )G53 - 201
33X-RAY DIFFRACTION33( CHAIN G AND RESID 202:284 )G202 - 284
34X-RAY DIFFRACTION34( CHAIN G AND RESID 285:329 )G285 - 329
35X-RAY DIFFRACTION35( CHAIN J AND RESID 3:27 )J3 - 27
36X-RAY DIFFRACTION36( CHAIN J AND RESID 28:60 )J28 - 60
37X-RAY DIFFRACTION37( CHAIN J AND RESID 61:161 )J61 - 161
38X-RAY DIFFRACTION38( CHAIN J AND RESID 162:251 )J162 - 251
39X-RAY DIFFRACTION39( CHAIN J AND RESID 252:313 )J252 - 313
40X-RAY DIFFRACTION40( CHAIN J AND RESID 314:329 )J314 - 329
41X-RAY DIFFRACTION41( CHAIN E AND RESID 3:27 )E3 - 27
42X-RAY DIFFRACTION42( CHAIN E AND RESID 28:59 )E28 - 59
43X-RAY DIFFRACTION43( CHAIN E AND RESID 60:134 )E60 - 134
44X-RAY DIFFRACTION44( CHAIN E AND RESID 135:184 )E135 - 184
45X-RAY DIFFRACTION45( CHAIN E AND RESID 185:230 )E185 - 230
46X-RAY DIFFRACTION46( CHAIN E AND RESID 231:251 )E231 - 251
47X-RAY DIFFRACTION47( CHAIN E AND RESID 252:313 )E252 - 313
48X-RAY DIFFRACTION48( CHAIN E AND RESID 314:329 )E314 - 329
49X-RAY DIFFRACTION49( CHAIN L AND RESID 3:27 )L3 - 27
50X-RAY DIFFRACTION50( CHAIN L AND RESID 28:47 )L28 - 47
51X-RAY DIFFRACTION51( CHAIN L AND RESID 48:73 )L48 - 73
52X-RAY DIFFRACTION52( CHAIN L AND RESID 74:134 )L74 - 134
53X-RAY DIFFRACTION53( CHAIN L AND RESID 135:201 )L135 - 201
54X-RAY DIFFRACTION54( CHAIN L AND RESID 202:269 )L202 - 269
55X-RAY DIFFRACTION55( CHAIN L AND RESID 270:297 )L270 - 297
56X-RAY DIFFRACTION56( CHAIN L AND RESID 298:329 )L298 - 329
57X-RAY DIFFRACTION57( CHAIN C AND RESID 3:52 )C3 - 52
58X-RAY DIFFRACTION58( CHAIN C AND RESID 53:134 )C53 - 134
59X-RAY DIFFRACTION59( CHAIN C AND RESID 135:156 )C135 - 156
60X-RAY DIFFRACTION60( CHAIN C AND RESID 157:251 )C157 - 251
61X-RAY DIFFRACTION61( CHAIN C AND RESID 252:284 )C252 - 284
62X-RAY DIFFRACTION62( CHAIN C AND RESID 285:329 )C285 - 329
63X-RAY DIFFRACTION63( CHAIN F AND RESID 3:27 )F3 - 27
64X-RAY DIFFRACTION64( CHAIN F AND RESID 28:59 )F28 - 59
65X-RAY DIFFRACTION65( CHAIN F AND RESID 60:114 )F60 - 114
66X-RAY DIFFRACTION66( CHAIN F AND RESID 115:134 )F115 - 134
67X-RAY DIFFRACTION67( CHAIN F AND RESID 135:184 )F135 - 184
68X-RAY DIFFRACTION68( CHAIN F AND RESID 185:251 )F185 - 251
69X-RAY DIFFRACTION69( CHAIN F AND RESID 252:313 )F252 - 313
70X-RAY DIFFRACTION70( CHAIN F AND RESID 314:329 )F314 - 329
71X-RAY DIFFRACTION71( CHAIN A AND RESID 3:47 )A3 - 47
72X-RAY DIFFRACTION72( CHAIN A AND RESID 48:74 )A48 - 74
73X-RAY DIFFRACTION73( CHAIN A AND RESID 75:184 )A75 - 184
74X-RAY DIFFRACTION74( CHAIN A AND RESID 185:251 )A185 - 251
75X-RAY DIFFRACTION75( CHAIN A AND RESID 252:313 )A252 - 313
76X-RAY DIFFRACTION76( CHAIN A AND RESID 314:329 )A314 - 329

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