<?xml version="1.0" ?>
<wwPDB-validation-information xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:noNamespaceSchemaLocation="http://wwpdb.org/validation/schema/wwpdb_validation_v002.xsd">
	<Entry B_factor_type="FULL" CCP4version="7.0 (Gargrove)" DCC_R="0.22" DCC_Rfree="0.26" DCC_refinement_program="REFMAC" DataAnisotropy="0.162" DataCompleteness="97.99" EDS_R="0.22" EDS_resolution="1.70" EDS_resolution_low="30.33" Fo_Fc_correlation="0.956" IoverSigma="1.78(1.70A)" PDB-R="0.22" PDB-Rfree="0.26" PDB-deposition-date="2009-11-08" PDB-resolution="1.70" PDB-resolution-low="30.33" PDB-revision-date="2011-07-13" PDB-revision-number="2" RefmacVersion="5.8.0158" RestypesNotcheckedForBondAngleGeometry="GOL,DHT" TransNCS="The largest off-origin peak in the Patterson function is 7.55% of the height of the origin peak. No significant pseudotranslation is detected." TwinL="0.496" TwinL2="0.330" WilsonBaniso="[34.166,29.046,31.689,0.000,-0.139,0.000]" WilsonBestimate="31.405" XMLcreationDate="Mar 13, 2018 -- 06:25 pm GMT" absolute-percentile-DCC_Rfree="28.4" absolute-percentile-clashscore="38.7" absolute-percentile-percent-RSRZ-outliers="7.6" absolute-percentile-percent-rama-outliers="100.0" absolute-percentile-percent-rota-outliers="20.5" acentric_outliers="3" angles_rmsz="0.85" attemptedValidationSteps="mogul,molprobity,validation-pack,xtriage,eds,percentiles,writexml" babinet_b="400.000" babinet_k="0.051" bonds_rmsz="0.82" bulk_solvent_b="56.747" bulk_solvent_k="0.427" centric_outliers="0" clashscore="8.10" high-resol-relative-percentile-DCC_Rfree="1.7" high-resol-relative-percentile-clashscore="1.7" high-resol-relative-percentile-percent-RSRZ-outliers="1.7" high-resol-relative-percentile-percent-rama-outliers="1.7" high-resol-relative-percentile-percent-rota-outliers="1.7" low-resol-relative-percentile-DCC_Rfree="1.7" low-resol-relative-percentile-clashscore="1.7" low-resol-relative-percentile-percent-RSRZ-outliers="1.7" low-resol-relative-percentile-percent-rama-outliers="1.7" low-resol-relative-percentile-percent-rota-outliers="1.7" num-H-reduce="2248" num-free-reflections="1716" numMillerIndices="34119" numPDBids-absolute-percentile-DCC_Rfree="111664" numPDBids-absolute-percentile-clashscore="122126" numPDBids-absolute-percentile-percent-RSRZ-outliers="108989" numPDBids-absolute-percentile-percent-rama-outliers="120053" numPDBids-absolute-percentile-percent-rota-outliers="120020" numPDBids-relative-percentile-DCC_Rfree="3793" numPDBids-relative-percentile-clashscore="4167" numPDBids-relative-percentile-percent-RSRZ-outliers="3718" numPDBids-relative-percentile-percent-rama-outliers="4100" numPDBids-relative-percentile-percent-rota-outliers="4100" num_angles_rmsz="2967" num_bonds_rmsz="2188" pdbid="3KLM" percent-RSRZ-outliers="9.75" percent-free-reflections="5.03" percent-rama-outliers="0.00" percent-rota-outliers="6.11" percentilebins="all,1.7,xray" protein-DNA-RNA-entities="1" relative-percentile-DCC_Rfree="7.6" relative-percentile-clashscore="23.2" relative-percentile-percent-RSRZ-outliers="8.4" relative-percentile-percent-rama-outliers="100.0" relative-percentile-percent-rota-outliers="5.8" resol-high-from-reflectionsfile="1.70" resol-low-from-reflectionsfile="30.33" xtriage_input_columns="F_meas_au,F_meas_sigma_au"/>
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		<clash atom="HA2" cid="22" clashmag="0.47" dist="2.45"/>
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		<mog-angle-outlier Zscore="2.25" atoms="C18,C13,C14" mean="111.72" mindiff="0.11" numobs="3288" obsval="115.98" stdev="1.90"/>
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		<clash atom="H72" cid="0" clashmag="0.77" dist="1.66"/>
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		<mog-angle-outlier Zscore="-2.04" atoms="C14,C8,C9" mean="109.09" mindiff="0.04" numobs="2436" obsval="106.34" stdev="1.35"/>
		<mog-angle-outlier Zscore="-3.27" atoms="C10,C9,C8" mean="112.41" mindiff="0.01" numobs="1015" obsval="108.88" stdev="1.08"/>
		<mog-angle-outlier Zscore="-3.41" atoms="C11,C9,C10" mean="113.90" mindiff="0.03" numobs="900" obsval="109.84" stdev="1.19"/>
		<mog-angle-outlier Zscore="-2.19" atoms="C1,C10,C9" mean="111.36" mindiff="0.00" numobs="1600" obsval="107.88" stdev="1.59"/>
		<mog-angle-outlier Zscore="-3.22" atoms="C11,C12,C13" mean="112.79" mindiff="0.09" numobs="4419" obsval="107.22" stdev="1.73"/>
		<mog-angle-outlier Zscore="3.87" atoms="C14,C13,C17" mean="99.25" mindiff="0.12" numobs="209" obsval="103.24" stdev="1.03"/>
		<mog-angle-outlier Zscore="-5.10" atoms="C13,C14,C8" mean="114.38" mindiff="0.03" numobs="1729" obsval="106.66" stdev="1.51"/>
		<mog-angle-outlier Zscore="-2.04" atoms="C15,C14,C8" mean="119.07" mindiff="0.03" numobs="2586" obsval="115.84" stdev="1.58"/>
		<clash atom="H191" cid="24" clashmag="0.46" dist="1.98"/>
		<clash atom="C12" cid="31" clashmag="0.42" dist="2.48"/>
		<clash atom="H192" cid="2" clashmag="0.73" dist="1.70"/>
		<clash atom="C19" cid="10" clashmag="0.57" dist="2.34"/>
		<clash atom="H122" cid="9" clashmag="0.57" dist="1.85"/>
		<clash atom="H41" cid="5" clashmag="0.62" dist="1.64"/>
		<clash atom="H41" cid="11" clashmag="0.55" dist="2.42"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="X" ent="3" icode=" " ligand_clashes_outlier="yes" ligand_num_clashes="7" ligand_num_symm_clashes="0" model="1" mogul_angles_rmsz="0.83" mogul_bonds_rmsz="0.61" mogul_rmsz_numangles="5" mogul_rmsz_numbonds="5" num-H-reduce="8" owab="49.550" resname="GOL" resnum="328" rscc="0.570" rsr="0.231" said="C" seq=".">
		<clash atom="C1" cid="7" clashmag="0.59" dist="2.15"/>
		<clash atom="C1" cid="28" clashmag="0.43" dist="2.41"/>
		<clash atom="H11" cid="12" clashmag="0.54" dist="2.08"/>
		<clash atom="H12" cid="1" clashmag="0.74" dist="1.68"/>
		<clash atom="H12" cid="3" clashmag="0.72" dist="1.55"/>
		<clash atom="H12" cid="4" clashmag="0.65" dist="2.11"/>
		<clash atom="H12" cid="15" clashmag="0.52" dist="2.38"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="24.880" resname="HOH" resnum="329" rscc="0.943" rsr="0.269" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="28.080" resname="HOH" resnum="330" rscc="0.923" rsr="0.099" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="29.790" resname="HOH" resnum="331" rscc="0.973" rsr="0.101" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="35.750" resname="HOH" resnum="332" rscc="0.962" rsr="0.174" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="35.200" resname="HOH" resnum="333" rscc="0.969" rsr="0.120" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="34.620" resname="HOH" resnum="334" rscc="0.980" rsr="0.126" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="36.530" resname="HOH" resnum="335" rscc="0.946" rsr="0.216" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="26.950" resname="HOH" resnum="336" rscc="0.967" rsr="0.111" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="34.660" resname="HOH" resnum="337" rscc="0.929" rsr="0.069" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="39.850" resname="HOH" resnum="338" rscc="0.778" rsr="0.112" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="39.630" resname="HOH" resnum="339" rscc="0.952" rsr="0.134" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="39.150" resname="HOH" resnum="340" rscc="0.933" rsr="0.107" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="39.610" resname="HOH" resnum="341" rscc="0.832" rsr="0.132" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="36.050" resname="HOH" resnum="342" rscc="0.937" rsr="0.070" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="37.720" resname="HOH" resnum="343" rscc="0.969" rsr="0.109" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="37.170" resname="HOH" resnum="344" rscc="0.971" rsr="0.054" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="36.650" resname="HOH" resnum="345" rscc="0.938" rsr="0.074" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="32.330" resname="HOH" resnum="346" rscc="0.915" rsr="0.124" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="46.980" resname="HOH" resnum="347" rscc="0.805" rsr="0.218" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="44.590" resname="HOH" resnum="348" rscc="0.940" rsr="0.118" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="70.650" resname="HOH" resnum="349" rscc="0.887" rsr="0.236" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="71.170" resname="HOH" resnum="350" rscc="0.596" rsr="0.102" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="47.910" resname="HOH" resnum="351" rscc="0.865" rsr="0.078" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="43.770" resname="HOH" resnum="352" rscc="0.895" rsr="0.147" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="44.150" resname="HOH" resnum="353" rscc="0.850" rsr="0.131" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="38.720" resname="HOH" resnum="354" rscc="0.927" rsr="0.132" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="48.170" resname="HOH" resnum="355" rscc="0.918" rsr="0.217" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="47.130" resname="HOH" resnum="356" rscc="0.790" rsr="0.281" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="54.210" resname="HOH" resnum="357" rscc="0.934" rsr="0.156" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="38.280" resname="HOH" resnum="358" rscc="0.883" rsr="0.131" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="65.990" resname="HOH" resnum="359" rscc="0.660" rsr="0.137" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="35.600" resname="HOH" resnum="360" rscc="0.982" rsr="0.049" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="35.560" resname="HOH" resnum="361" rscc="0.916" rsr="0.107" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="46.110" resname="HOH" resnum="362" rscc="0.860" rsr="0.336" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="59.310" resname="HOH" resnum="363" rscc="0.766" rsr="0.216" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="55.630" resname="HOH" resnum="364" rscc="0.755" rsr="0.336" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="36.480" resname="HOH" resnum="365" rscc="0.987" rsr="0.329" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="36.660" resname="HOH" resnum="366" rscc="0.968" rsr="0.097" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="43.790" resname="HOH" resnum="367" rscc="0.809" rsr="0.281" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="43.610" resname="HOH" resnum="368" rscc="0.948" rsr="0.159" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="49.730" resname="HOH" resnum="369" rscc="0.919" rsr="0.172" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="61.140" resname="HOH" resnum="370" rscc="0.820" rsr="0.165" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="X" ent="4" icode=" " model="1" owab="72.380" resname="HOH" resnum="371" rscc="0.538" rsr="0.111" said="D" seq=".">
		<clash atom="O" cid="17" clashmag="0.52" dist="2.42"/>
	</ModelledSubgroup>
	<ModelledEntityInstance absolute_RSRZ_percentile="7.56" absolute_rama_percentile="100.00" absolute_sidechain_percentile="20.98" angles_rmsz="0.85" bonds_rmsz="0.82" chain="X" ent="1" model="1" num_angles_rmsz="2967" num_bonds_rmsz="2188" relative_RSRZ_percentile="8.45" relative_rama_percentile="100.00" relative_sidechain_percentile="6.15" said="A"/>
	<programs>
		<program name="dcc" properties="DCC_R,DCC_refinement_program,B_factor_type,DCC_Rfree" version="2.23  (2018-02-06)"/>
		<program name="validation-pipeline" properties="PDB-revision-date,PDB-resolution,protein-DNA-RNA-entities,PDB-Rfree,PDB-R,percentilebins,PDB-resolution-low,PDB-revision-number,pdbid,resol-high-from-reflectionsfile,attemptedValidationSteps,XMLcreationDate,resol-low-from-reflectionsfile,PDB-deposition-date" version="trunk31020"/>
		<program name="mogul" properties="mogul_rmsz_numangles,mogul_angles_rmsz,mogul-torsion-outlier,mogul-angle-outlier,mogul-bond-outlier,mogul_bonds_rmsz,mogul-ring-outlier,mogul_rmsz_numbonds" version="1.7.3 (157068), CSD as539be (2018)"/>
		<program name="eds" properties="rscc,owab,EDS_R,avgoccu,EDS_resolution_low,CCP4version,babinet_b,num-free-reflections,relative_RSRZ_percentile,rsrz,DataCompleteness,percent-RSRZ-outliers,bulk_solvent_b,RefmacVersion,bulk_solvent_k,percent-free-reflections,EDS_resolution,Fo_Fc_correlation,rsr,NatomsEDS,babinet_k,absolute_RSRZ_percentile" version="trunk31020"/>
		<program name="xtriage" properties="xtriage_input_columns,numMillerIndices,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,TwinL2,IoverSigma,WilsonBaniso" version="1.13"/>
		<program name="molprobity" properties="relative_rama_percentile,ligand_num_clashes,absolute_sidechain_percentile,angles_rmsz,absolute_rama_percentile,phi,psi,num-H-reduce,clash,relative_sidechain_percentile,clashscore,bonds_rmsz,percent-rama-outliers,ligand_clashes_outlier,percent-rota-outliers,flippable-sidechain,bond-outlier,angle-outlier,num_bonds_rmsz,ligand_num_symm_clashes,RestypesNotcheckedForBondAngleGeometry,rota,num_angles_rmsz,rama" version="4.02b-467"/>
		<program name="percentiles" properties="numPDBids-absolute-percentile-percent-rota-outliers,high-resol-relative-percentile-percent-rota-outliers,absolute-percentile-percent-RSRZ-outliers,relative-percentile-percent-rama-outliers,absolute-percentile-percent-rama-outliers,absolute-percentile-clashscore,absolute-percentile-percent-rota-outliers,relative-percentile-clashscore,high-resol-relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-DCC_Rfree,absolute-percentile-DCC_Rfree,relative-percentile-DCC_Rfree,relative-percentile-percent-RSRZ-outliers,low-resol-relative-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-clashscore,high-resol-relative-percentile-clashscore,numPDBids-absolute-percentile-percent-RSRZ-outliers,low-resol-relative-percentile-clashscore,numPDBids-relative-percentile-percent-rota-outliers,low-resol-relative-percentile-percent-rama-outliers,low-resol-relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-clashscore,numPDBids-absolute-percentile-percent-rama-outliers,low-resol-relative-percentile-DCC_Rfree,high-resol-relative-percentile-percent-RSRZ-outliers,numPDBids-absolute-percentile-DCC_Rfree,relative-percentile-percent-rota-outliers,high-resol-relative-percentile-DCC_Rfree" version="20171227.v01 (using entries in the PDB archive December 27th 2017)"/>
	</programs>
</wwPDB-validation-information>
