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	<Entry percentilebins="all,nmr" attemptedValidationSteps="mogul,buster-report,molprobity,validation-pack,coreclust,chemicalshiftanalysis,percentiles,writexml" PDB-deposition-date="2019-03-25" PDB-revision-date="2024-05-01" PDB-revision-number="4" protein-DNA-RNA-entities="1" PDB-resolution="NotAvailable" PDB-resolution-low="NotAvailable" PDB-R="NotAvailable" PDB-Rfree="NotAvailable" pdbid="6OCV" extended_pdbid="6OCV" ligands-for-buster-report="yes" clashscore-full-length="8.12" angles_rmsz="1.19" num_bonds_rmsz="31220" RestypesNotcheckedForBondAngleGeometry="CMO,HEM" num-H-reduce="30320" percent-rama-outliers-full-length="2.66" bonds_rmsz="1.04" percent-rota-outliers-full-length="8.28" num_angles_rmsz="42160" cyrange_number_of_domains="1" cyrange_version="Kirchner and G\&quot;{u}ntert (2011)" shiftchecker_version="v1.2" cyrange_error="success" nmr_models_consistency_flag="True" nmrclust_error="success" chemical_shift_completeness="87.49" nmrclust_representative_model="12" nmrclust_version="Kelley et al. (1996)" rci_version="v_1n_11_5_13_A (Berjanski et al., 2005)" nmrclust_number_of_clusters="6" chemical_shift_completeness_full_length="86.45" medoid_model="19" panav_version="Wang et al. (2010)" nmrclust_number_of_models="20" nmrclust_number_of_outliers="1" clashscore="8.32" percent-rama-outliers="2.44" percent-rota-outliers="8.08" absolute-percentile-clashscore="33.2" numPDBids-absolute-percentile-clashscore="229148" relative-percentile-clashscore="56.0" numPDBids-relative-percentile-clashscore="14424" absolute-percentile-percent-rama-outliers="6.6" numPDBids-absolute-percentile-percent-rama-outliers="224038" relative-percentile-percent-rama-outliers="44.2" numPDBids-relative-percentile-percent-rama-outliers="12848" absolute-percentile-percent-rota-outliers="12.9" numPDBids-absolute-percentile-percent-rota-outliers="223484" relative-percentile-percent-rota-outliers="60.1" numPDBids-relative-percentile-percent-rota-outliers="12823" XMLcreationDate="Mar  5, 2026 -- 05:18 AM UTC" bmrb_id="27284">
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		<mog-bond-outlier atoms="C3B,C4B" numobs="106" mean="1.44" stdev="0.02" mindiff="0.01" Zscore="-4.15" obsval="1.36"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="285" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-4.23" obsval="1.37"/>
		<mog-bond-outlier atoms="CMC,C2C" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.55" obsval="1.45"/>
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		<mog-bond-outlier atoms="C1D,C2D" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-3.75" obsval="1.36"/>
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		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="4071" mean="118.29" stdev="50.65" mindiff="0.07" local_density="4.94" obsval="-21.11"/>
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		<mog-torsion-outlier atoms="C2D,C3D,CAD,CBD" numobs="939" mean="58.44" stdev="12.83" mindiff="13.52" local_density="0.00" obsval="-151.52"/>
		<mog-torsion-outlier atoms="C4D,C3D,CAD,CBD" numobs="751" mean="51.59" stdev="12.01" mindiff="4.25" local_density="0.13" obsval="35.83"/>
		<mog-torsion-outlier atoms="C3D,CAD,CBD,CGD" numobs="469" mean="50.37" stdev="9.23" mindiff="10.99" local_density="0.00" obsval="123.32"/>
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		<clash atom="HBD1" dist="1.35" clashmag="0.95" cid="390"/>
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	<Model nmrclust_cluster_id="3" model="4"/>
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		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="899" mean="72.91" stdev="15.30" mindiff="13.48" local_density="0.00" obsval="-17.55"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4071" mean="88.83" stdev="35.89" mindiff="0.06" local_density="3.51" obsval="121.81"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="4071" mean="88.60" stdev="35.85" mindiff="0.07" local_density="3.64" obsval="-59.01"/>
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	<Model nmrclust_cluster_id="outlier" model="8"/>
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		<mog-bond-outlier atoms="C3B,C4B" numobs="106" mean="1.44" stdev="0.02" mindiff="0.01" Zscore="-4.08" obsval="1.37"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="285" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-4.29" obsval="1.36"/>
		<mog-bond-outlier atoms="CMC,C2C" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.49" obsval="1.45"/>
		<mog-bond-outlier atoms="C3C,C4C" numobs="90" mean="1.46" stdev="0.02" mindiff="0.04" Zscore="-5.14" obsval="1.37"/>
		<mog-bond-outlier atoms="C1D,C2D" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-3.77" obsval="1.36"/>
		<mog-bond-outlier atoms="CMD,C2D" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.64" obsval="1.45"/>
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		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4071" mean="47.71" stdev="26.70" mindiff="0.03" local_density="4.10" obsval="51.29"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="4071" mean="48.01" stdev="26.14" mindiff="0.06" local_density="4.00" obsval="-128.59"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="99" mean="50.85" stdev="23.88" mindiff="0.58" local_density="2.02" obsval="-118.56"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="103" mean="68.29" stdev="12.93" mindiff="33.45" local_density="0.00" obsval="94.55"/>
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	<Model nmrclust_cluster_id="2" model="11"/>
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	<ModelledSubgroup num-H-reduce="6" phi="-133.9" psi="82.8" rama="Favored" rota="t0" cyrange_domain_id="1" validate="True" model="20" chain="A" resnum="176" said="A" ent="1" seq="176" icode=" " resname="ASN" altcode=" "/>
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	<ModelledSubgroup num-H-reduce="7" phi="-118.3" psi="144.2" rama="Favored" rota="m" cyrange_domain_id="1" validate="True" model="20" chain="A" resnum="178" said="A" ent="1" seq="178" icode=" " resname="THR" altcode=" "/>
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	<ModelledSubgroup mogul_rmsz_numbonds="0" validate="True" model="20" chain="A" resnum="201" said="B" ent="2" seq="." icode=" " resname="CMO" altcode=" "/>
	<ModelledSubgroup mogul_bonds_rmsz="2.20" mogul_rmsz_numbonds="50" mogul_angles_rmsz="1.00" mogul_rmsz_numangles="67" num-H-reduce="30" validate="True" model="20" chain="A" resnum="202" said="C" ent="3" seq="." icode=" " resname="HEM" altcode=" ">
		<mog-bond-outlier atoms="CHD,C4C" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.80" obsval="1.43"/>
		<mog-bond-outlier atoms="C1A,C2A" numobs="3047" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-3.82" obsval="1.37"/>
		<mog-bond-outlier atoms="CAA,C2A" numobs="2735" mean="1.51" stdev="0.03" mindiff="0.00" Zscore="-2.27" obsval="1.45"/>
		<mog-bond-outlier atoms="C4A,C3A" numobs="568" mean="1.43" stdev="0.02" mindiff="0.00" Zscore="-2.63" obsval="1.37"/>
		<mog-bond-outlier atoms="CMA,C3A" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.57" obsval="1.45"/>
		<mog-bond-outlier atoms="CBA,CGA" numobs="4776" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.22" obsval="1.45"/>
		<mog-bond-outlier atoms="O2A,CGA" numobs="10681" mean="1.30" stdev="0.03" mindiff="0.00" Zscore="-2.55" obsval="1.22"/>
		<mog-bond-outlier atoms="C1B,C2B" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-3.76" obsval="1.36"/>
		<mog-bond-outlier atoms="CMB,C2B" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.53" obsval="1.45"/>
		<mog-bond-outlier atoms="C3B,C4B" numobs="106" mean="1.44" stdev="0.02" mindiff="0.01" Zscore="-4.06" obsval="1.37"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="285" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-4.16" obsval="1.37"/>
		<mog-bond-outlier atoms="CMC,C2C" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.52" obsval="1.45"/>
		<mog-bond-outlier atoms="C3C,C4C" numobs="90" mean="1.46" stdev="0.02" mindiff="0.04" Zscore="-5.10" obsval="1.37"/>
		<mog-bond-outlier atoms="C1D,C2D" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-3.75" obsval="1.36"/>
		<mog-bond-outlier atoms="CMD,C2D" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.73" obsval="1.45"/>
		<mog-bond-outlier atoms="C4D,C3D" numobs="5746" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-4.68" obsval="1.37"/>
		<mog-bond-outlier atoms="CAD,C3D" numobs="2735" mean="1.51" stdev="0.03" mindiff="0.00" Zscore="-2.31" obsval="1.45"/>
		<mog-bond-outlier atoms="CBD,CGD" numobs="4776" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="-2.19" obsval="1.45"/>
		<mog-bond-outlier atoms="O2D,CGD" numobs="10681" mean="1.30" stdev="0.03" mindiff="0.00" Zscore="-2.56" obsval="1.22"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="24" mean="109.47" stdev="0.72" mindiff="0.74" Zscore="2.75" obsval="111.44"/>
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="476" mean="38.06" stdev="14.40" mindiff="8.29" local_density="0.63" obsval="-53.65"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="899" mean="45.53" stdev="13.80" mindiff="0.39" local_density="0.44" obsval="135.44"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="469" mean="51.90" stdev="8.72" mindiff="6.25" local_density="0.21" obsval="-118.58"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="103" mean="54.12" stdev="35.33" mindiff="1.64" local_density="1.94" obsval="55.11"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="99" mean="58.55" stdev="12.89" mindiff="17.33" local_density="0.00" obsval="-100.66"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="103" mean="61.33" stdev="18.95" mindiff="21.72" local_density="0.00" obsval="75.19"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="99" mean="45.97" stdev="33.37" mindiff="1.50" local_density="4.04" obsval="-130.92"/>
		<mog-torsion-outlier atoms="C2D,C3D,CAD,CBD" numobs="939" mean="56.03" stdev="12.22" mindiff="20.16" local_density="0.00" obsval="37.18"/>
		<mog-torsion-outlier atoms="C4D,C3D,CAD,CBD" numobs="751" mean="47.96" stdev="11.80" mindiff="11.53" local_density="0.00" obsval="-135.33"/>
		<mog-torsion-outlier atoms="C3D,CAD,CBD,CGD" numobs="469" mean="55.62" stdev="14.73" mindiff="1.00" local_density="0.64" obsval="107.11"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="4071" mean="79.27" stdev="29.60" mindiff="0.00" local_density="3.39" obsval="107.82"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="4071" mean="79.54" stdev="29.75" mindiff="0.10" local_density="3.32" obsval="-72.30"/>
		<clash atom="HBD1" dist="2.02" clashmag="0.83" cid="367"/>
		<clash atom="HBD1" dist="1.71" clashmag="0.62" cid="369"/>
		<clash atom="CMD" dist="2.02" clashmag="0.83" cid="367"/>
		<clash atom="C2B" dist="2.19" clashmag="0.72" cid="368"/>
		<clash atom="HMD2" dist="1.71" clashmag="0.62" cid="369"/>
		<clash atom="HMD2" dist="2.39" clashmag="0.45" cid="374"/>
		<clash atom="C1C" dist="2.35" clashmag="0.56" cid="370"/>
		<clash atom="HHA" dist="2.37" clashmag="0.50" cid="371"/>
		<clash atom="HHA" dist="1.85" clashmag="0.48" cid="372"/>
		<clash atom="CBA" dist="2.37" clashmag="0.50" cid="371"/>
		<clash atom="HBA2" dist="1.85" clashmag="0.48" cid="372"/>
		<clash atom="CMB" dist="2.40" clashmag="0.46" cid="373"/>
		<clash atom="CMB" dist="3.00" clashmag="0.40" cid="376"/>
		<clash atom="CBD" dist="2.39" clashmag="0.45" cid="374"/>
		<clash atom="C3B" dist="2.48" clashmag="0.41" cid="375"/>
	</ModelledSubgroup>
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	<ModelledEntityInstance bonds_rmsz="1.05" num_bonds_rmsz="1561" angles_rmsz="1.20" num_angles_rmsz="2108" absolute_sidechain_percentile="10.74" relative_sidechain_percentile="10.74" absolute_rama_percentile="2.90" relative_rama_percentile="2.90" said="A" model="19" chain="A" ent="1"/>
	<ModelledEntityInstance bonds_rmsz="1.04" num_bonds_rmsz="1561" angles_rmsz="1.19" num_angles_rmsz="2108" absolute_sidechain_percentile="10.74" relative_sidechain_percentile="10.74" absolute_rama_percentile="3.72" relative_rama_percentile="3.72" said="A" model="20" chain="A" ent="1"/>
	<programs>
		<program name="validation-pipeline" version="2.49" properties="PDB-resolution-low,PDB-R,PDB-Rfree,XMLcreationDate,percentilebins,PDB-revision-number,extended_pdbid,PDB-revision-date,attemptedValidationSteps,protein-DNA-RNA-entities,PDB-deposition-date,PDB-resolution,pdbid"/>
		<program name="mogul" version="2022.3.0, CSD as543be (2022)" properties="mogul-angle-outlier,mogul_bonds_rmsz,mogul-bond-outlier,mogul-torsion-outlier,mogul_rmsz_numangles,mogul_rmsz_numbonds,mogul_angles_rmsz"/>
		<program name="buster-report" version="wwPDB partial adaption of 1.1.7 (2018)" properties="ligands-for-buster-report"/>
		<program name="molprobity" version="4-5-2 with Phenix2.0" properties="clashscore-full-length,angles_rmsz,num_bonds_rmsz,absolute_sidechain_percentile,psi,RestypesNotcheckedForBondAngleGeometry,relative_rama_percentile,phi,num-H-reduce,relative_sidechain_percentile,bond-outlier,absolute_rama_percentile,percent-rama-outliers-full-length,bonds_rmsz,percent-rota-outliers-full-length,num_angles_rmsz,angle-outlier,clash,rama,rota"/>
		<program name="chemicalshiftanalysis" version="v1.2" properties="rci_version,chemical_shift_completeness_full_length,shiftchecker_version,chemical_shift_completeness,panav_version"/>
		<program name="coreclust" version="2.49" properties="nmrclust_version,cyrange_error,nmrclust_representative_model,nmrclust_number_of_clusters,nmrclust_number_of_models,cyrange_number_of_domains,cyrange_domain_id,nmrclust_representative,nmrclust_number_of_outliers,nmrclust_error,cyrange_version,validate,nmrclust_cluster_id,medoid_model"/>
		<program name="coreclust" version="unknown" properties="nmr_models_consistency_flag"/>
		<program name="nmrwriter" version="2.49" properties="clashscore,percent-rota-outliers,percent-rama-outliers"/>
		<program name="percentiles" version="20250101.v01 (using entries in the PDB archive January 1st 2025)" properties="numPDBids-relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-clashscore,numPDBids-absolute-percentile-percent-rama-outliers,absolute-percentile-percent-rama-outliers,absolute-percentile-percent-rota-outliers,absolute-percentile-clashscore,relative-percentile-percent-rota-outliers,relative-percentile-percent-rama-outliers,relative-percentile-clashscore,numPDBids-absolute-percentile-percent-rota-outliers,numPDBids-relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-clashscore"/>
	</programs>
</wwPDB-validation-information>
