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9BT

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NASCANdoub1.29Å1.33ÅAromatic
NASCBAsing1.31Å1.35ÅAromatic
CANSAVsing1.71Å1.65ÅAromatic
CAACBAsing1.51Å1.54Å
CBACBCdoub1.35Å1.34ÅAromatic
SAVCBCsing1.76Å1.72ÅAromatic
CBCCBBsing1.48Å1.35Å
CBBCAMdoub1.40Å1.40ÅAromatic
CBBCALsing1.40Å1.39ÅAromatic
CAMCAKsing1.38Å1.40ÅAromatic
CALCAJdoub1.38Å1.41ÅAromatic
CAKCAZdoub1.38Å1.39ÅAromatic
CAJCAZsing1.38Å1.40ÅAromatic
CAZCAPsing1.51Å1.40Å
CAPNATsing1.46Å1.48Å
NATCsing1.35Å1.34Å
CBCAsing1.54Å1.55Å
CBCGsing1.55Å1.52Å
COdoub1.21Å1.23Å
CCAsing1.51Å1.41Å
CANsing1.47Å1.51Å
CGOD1sing1.43Å1.43Å
CGCD2sing1.55Å1.54Å
NCD2sing1.47Å1.50Å
NCAYsing1.35Å1.35Å
OAGCAYdoub1.21Å1.23Å
CAYCBFsing1.51Å1.55Å
CABCBHsing1.53Å1.55Å
CBFCBHsing1.53Å1.55Å
CBFNAUsing1.47Å1.46Å
CACCBHsing1.53Å1.56Å
CBHCADsing1.53Å1.55Å
NAUCAWsing1.35Å1.33Å
CAWOAEdoub1.21Å1.23Å
CAWCAOsing1.51Å1.53Å
CAOOAHsing1.43Å1.42Å
CAAH1sing1.09Å1.10Å
CAAH2sing1.09Å1.10Å
CAAH3sing1.09Å1.10Å
CANH4sing1.08Å1.08Å
CAMH5sing1.08Å1.08Å
CAKH6sing1.08Å1.08Å
CALH7sing1.08Å1.08Å
CAJH8sing1.08Å1.08Å
CAPH9sing1.09Å1.10Å
CAPH10sing1.09Å1.10Å
NATH11sing0.97Å1.00Å
CAH12sing1.09Å1.10Å
CBH13sing1.09Å1.10Å
CBH14sing1.09Å1.10Å
CGH15sing1.09Å1.10Å
OD1H16sing0.97Å0.95Å
CD2H17sing1.09Å1.10Å
CD2H18sing1.09Å1.10Å
CBFH19sing1.09Å1.10Å
CACH20sing1.09Å1.10Å
CACH21sing1.09Å1.10Å
CACH22sing1.09Å1.10Å
CADH23sing1.09Å1.10Å
CADH24sing1.09Å1.10Å
CADH25sing1.09Å1.10Å
CABH26sing1.09Å1.10Å
CABH27sing1.09Å1.10Å
CABH28sing1.09Å1.10Å
NAUH29sing0.97Å1.00Å
CAOH30sing1.09Å1.10Å
CAOH31sing1.09Å1.10Å
OAHH32sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CANNASCBA115.3°117.3°
NASCANSAV108.0°110.4°
NASCANH4126.0°124.8°
NASCBACAA118.7°122.9°
NASCBACBC115.4°114.2°
CANSAVCBC95.8°90.3°
SAVCANH4126.0°124.8°
CAACBACBC125.8°122.9°
CBACAAH1109.5°109.5°
CBACAAH2109.5°109.4°
CBACAAH3109.5°109.5°
CBACBCSAV105.4°107.8°
CBACBCCBB127.6°126.1°
SAVCBCCBB127.0°126.1°
CBCCBBCAM122.3°120.1°
CBCCBBCAL120.6°120.1°
CAMCBBCAL117.1°119.7°
CBBCAMCAK121.1°119.8°
CBBCAMH5119.4°120.1°
CBBCALCAJ121.8°119.9°
CBBCALH7119.1°120.1°
CAMCAKCAZ121.9°120.2°
CAKCAMH5119.4°120.1°
CAMCAKH6119.1°119.9°
CALCAJCAZ120.8°120.2°
CAJCALH7119.2°120.0°
CALCAJH8119.6°119.9°
CAKCAZCAJ117.2°120.2°
CAKCAZCAP117.9°119.9°
CAZCAKH6119.0°119.9°
CAJCAZCAP124.9°119.9°
CAZCAJH8119.6°119.9°
CAZCAPNAT110.3°109.5°
CAZCAPH9109.3°109.5°
CAZCAPH10109.2°109.5°
CAPNATC123.8°120.1°
NATCAPH9109.3°109.4°
NATCAPH10109.3°109.5°
CAPNATH11118.1°120.0°
NATCO122.3°119.9°
NATCCA115.8°120.0°
CNATH11118.1°120.0°
CACBCG106.2°103.0°
CBCAC108.1°109.9°
CBCAN104.9°107.3°
CBCAH12108.9°110.0°
CACBH13110.3°110.7°
CACBH14110.3°110.7°
CBCGOD1109.6°111.0°
CBCGCD2103.5°101.6°
CGCBH13110.3°110.7°
CGCBH14110.3°110.8°
CBCGH15110.2°111.0°
OCCA121.8°120.0°
CCAN114.4°109.9°
CCAH12110.8°109.9°
CANCD2109.1°108.7°
CANCAY120.2°125.7°
NCAH12109.4°109.9°
OD1CGCD2111.9°111.0°
OD1CGH15111.5°110.9°
CGOD1H16109.5°114.0°
CGCD2N105.5°104.8°
CD2CGH15109.9°111.1°
CGCD2H17110.4°110.4°
CGCD2H18110.4°110.3°
CD2NCAY130.7°125.6°
NCD2H17110.4°110.4°
NCD2H18110.5°110.5°
NCAYOAG122.5°120.0°
NCAYCBF118.2°120.0°
OAGCAYCBF119.3°120.0°
CAYCBFCBH113.1°109.5°
CAYCBFNAU104.1°109.5°
CAYCBFH19109.5°109.4°
CABCBHCBF110.9°109.5°
CABCBHCAC107.8°109.4°
CABCBHCAD108.4°109.5°
CBHCABH26109.5°109.4°
CBHCABH27109.5°109.5°
CBHCABH28109.5°109.4°
CBHCBFNAU109.8°109.5°
CBFCBHCAC113.3°109.5°
CBFCBHCAD107.9°109.5°
CBHCBFH19109.5°109.5°
CBFNAUCAW126.4°120.0°
NAUCBFH19110.8°109.5°
CBFNAUH29116.8°119.9°
CACCBHCAD108.5°109.5°
CBHCACH20109.5°109.4°
CBHCACH21109.5°109.5°
CBHCACH22109.5°109.5°
CBHCADH23109.5°109.5°
CBHCADH24109.5°109.5°
CBHCADH25109.5°109.5°
NAUCAWOAE125.6°120.0°
NAUCAWCAO111.7°120.0°
CAWNAUH29116.8°120.1°
OAECAWCAO122.5°120.0°
CAWCAOOAH104.7°109.5°
CAWCAOH30110.7°109.5°
CAWCAOH31110.7°109.5°
OAHCAOH30110.6°109.5°
OAHCAOH31110.7°109.4°
CAOOAHH32109.5°114.0°
H1CAAH2109.5°109.4°
H1CAAH3109.4°109.5°
H2CAAH3109.5°109.5°
H9CAPH10109.5°109.4°
H13CBH14109.5°110.7°
H17CD2H18109.5°110.3°
H20CACH21109.4°109.5°
H20CACH22109.5°109.5°
H21CACH22109.5°109.5°
H23CADH24109.5°109.4°
H23CADH25109.4°109.4°
H24CADH25109.4°109.4°
H26CABH27109.5°109.5°
H26CABH28109.4°109.5°
H27CABH28109.4°109.5°
H30CAOH31109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NASCANSAVH4180.0°180.0°
CANNASCBACAA179.7°180.0°
CANNASCBACBC0.5°0.3°
NASCANSAVCBC0.9°0.1°
CBANASCANSAV0.4°0.1°
NASCBACAACBC179.2°179.7°
NASCBACBCSAV1.1°0.4°
NASCBACBCCBB179.0°179.7°
NASCBACAAH10.0°94.9°
NASCBACAAH2120.0°25.0°
NASCBACAAH3120.0°145.1°
CBANASCANH4179.6°180.0°
CANSAVCBCCBA1.1°0.3°
CANSAVCBCCBB179.1°179.8°
CAACBACBCSAV179.8°179.9°
CAACBACBCCBB1.8°0.0°
CBACAAH1H2120.0°120.0°
CBACAAH1H3120.0°120.0°
CBACAAH2H3120.0°120.0°
CBACBCSAVCBB178.0°179.9°
CBACBCCBBCAM42.8°132.2°
CBACBCCBBCAL136.6°48.2°
CBCCBACAAH1179.2°84.7°
CBCCBACAAH259.2°155.3°
CBCCBACAAH360.8°35.2°
SAVCBCCBBCAM139.7°47.6°
SAVCBCCBBCAL40.9°132.0°
CBCSAVCANH4179.1°179.8°
CBCCBBCAMCAL179.5°179.6°
CBCCBBCAMCAK179.2°180.0°
CBCCBBCALCAJ179.2°179.9°
CBCCBBCAMH50.8°0.1°
CBCCBBCALH70.8°0.1°
CBBCAMCAKH5180.0°179.9°
CAMCBBCALCAJ0.3°0.3°
CBBCAMCAKCAZ0.0°0.0°
CBBCAMCAKH6180.0°179.9°
CAMCBBCALH7179.7°179.7°
CALCBBCAMCAK0.3°0.3°
CBBCALCAJH7180.0°180.0°
CBBCALCAJCAZ0.0°0.0°
CALCBBCAMH5179.7°179.7°
CBBCALCAJH8180.0°180.0°
CAMCAKCAZH6180.0°179.9°
CAMCAKCAZCAJ0.2°0.4°
CAMCAKCAZCAP179.6°180.0°
CALCAJCAZCAK0.3°0.4°
CALCAJCAZH8180.0°179.9°
CALCAJCAZCAP179.6°180.0°
CAKCAZCAJCAP179.8°179.6°
CAKCAZCAPNAT162.5°90.0°
CAZCAKCAMH5180.0°179.9°
CAKCAZCAJH8179.8°179.7°
CAKCAZCAPH977.4°150.0°
CAKCAZCAPH1042.3°30.1°
CAJCAZCAPNAT17.7°89.7°
CAJCAZCAKH6179.8°179.7°
CAZCAJCALH7180.0°179.9°
CAJCAZCAPH9102.4°30.3°
CAJCAZCAPH10137.9°150.3°
CAZCAPNATH9120.1°120.0°
CAZCAPNATH10120.1°120.1°
CAZCAPNATC95.5°180.0°
CAPCAZCAKH60.4°0.1°
CAPCAZCAJH80.4°0.1°
CAZCAPH9H10119.6°120.0°
CAZCAPNATH1184.5°0.0°
CAPNATCH11180.0°180.0°
CAPNATCO1.1°0.0°
CAPNATCCA176.2°180.0°
NATCAPH9H10119.6°120.0°
NATCCACB91.6°62.2°
NATCOCA174.9°180.0°
NATCCAN151.9°180.0°
CNATCAPH9144.4°60.0°
CNATCAPH1024.7°60.0°
NATCCAH1227.6°59.0°
CACBCGH13119.5°118.3°
CACBCGH14119.5°118.4°
CBCACO83.5°117.8°
CBCACN116.4°117.8°
CBCACH12119.3°121.2°
CBCANH12116.7°119.6°
CACBCGOD187.1°82.6°
CACBCGCD232.4°35.5°
CBCANCD22.1°1.1°
CBCANCAY179.7°178.9°
CACBH13H14121.5°123.2°
CACBCGH15149.9°153.6°
CGCBCAC144.2°141.6°
CGCBCAN21.7°22.2°
CBCGOD1CD2114.2°112.2°
CBCGOD1H15122.2°123.9°
CBCGCD2H15117.7°118.1°
CBCGCD2N30.8°37.0°
CGCBCAH1295.4°97.3°
CGCBH13H14121.5°123.3°
CBCGOD1H16180.0°180.0°
CBCGCD2H1788.5°81.9°
CBCGCD2H18150.2°156.0°
OCCAN32.9°0.0°
OCNATH11178.9°180.0°
OCCAH12157.2°121.0°
CCANH12125.0°121.0°
CCANCD2120.4°118.3°
CCANCAY61.5°61.7°
CACNATH113.8°0.0°
CCACBH1324.7°23.2°
CCACBH1496.3°100.0°
CANCD2CG17.9°24.1°
CANCD2CAY177.9°180.0°
CANCAYOAG0.7°4.5°
CANCAYCBF178.7°175.4°
NCACBH1397.8°96.2°
NCACBH14141.2°140.6°
CANCD2H17101.4°94.7°
CANCD2H18137.3°143.0°
OD1CGCD2H15124.5°123.9°
OD1CGCD2N87.0°81.0°
OD1CGCBH13153.4°159.1°
OD1CGCBH1432.4°35.8°
OD1CGCD2H17153.6°160.1°
OD1CGCD2H1832.4°37.9°
CGCD2NH17119.4°118.9°
CGCD2NH18119.4°118.9°
CGCD2NCAY160.0°155.9°
CD2CGCBH1387.1°82.9°
CD2CGCBH14151.9°153.9°
CD2CGOD1H1665.8°67.8°
CGCD2H17H18121.8°122.2°
CD2NCAYOAG177.0°175.5°
CD2NCAYCBF1.0°4.6°
CD2NCAH12114.6°120.7°
NCD2CGH15148.5°155.1°
NCD2H17H18121.8°122.4°
NCAYOAGCBF178.0°179.9°
NCAYCBFCBH105.0°95.4°
NCAYCBFNAU136.0°144.6°
CAYNCAH1263.6°59.4°
CAYNCD2H1780.7°85.3°
CAYNCD2H1840.6°37.0°
NCAYCBFH1917.5°24.6°
OAGCAYCBFCBH77.0°84.7°
OAGCAYCBFNAU42.1°35.4°
OAGCAYCBFH19160.6°155.3°
CAYCBFCBHCAB56.5°175.2°
CAYCBFCBHNAU115.8°120.1°
CAYCBFCBHH19122.4°119.9°
CAYCBFNAUH19117.6°119.9°
CAYCBFCBHCAC64.9°64.9°
CAYCBFCBHCAD175.0°55.2°
CAYCBFNAUCAW108.7°155.0°
CAYCBFNAUH2971.3°25.1°
CABCBHCBFCAC121.3°120.0°
CABCBHCBFCAD118.5°120.0°
CABCBHCBFNAU172.2°64.8°
CABCBHCACCAD117.1°120.0°
CABCBHCBFH1966.0°55.2°
CABCBHCACH20180.0°180.0°
CABCBHCACH2160.0°60.0°
CABCBHCACH2260.0°60.0°
CABCBHCADH23180.0°55.7°
CABCBHCADH2460.0°64.3°
CABCBHCADH2560.0°175.7°
CBHCABH26H27120.0°120.0°
CBHCABH26H28120.0°120.0°
CBHCABH27H28120.0°120.0°
CBHCBFNAUH19121.1°120.0°
CBFCBHCACCAD119.8°120.1°
CBHCBFNAUCAW130.0°85.0°
CBFCBHCACH2056.9°60.0°
CBFCBHCACH2163.1°180.0°
CBFCBHCACH22176.9°60.0°
CBFCBHCADH2359.9°64.3°
CBFCBHCADH24179.9°175.6°
CBFCBHCADH2560.1°55.6°
CBFCBHCABH26180.0°59.9°
CBFCBHCABH2760.0°180.0°
CBFCBHCABH2860.0°60.0°
CBHCBFNAUH2950.1°95.0°
NAUCBFCBHCAC50.9°55.2°
NAUCBFCBHCAD69.3°175.2°
CBFNAUCAWH29180.0°179.9°
CBFNAUCAWOAE6.3°0.0°
CBFNAUCAWCAO179.0°180.0°
CACCBHCBFH19172.7°175.2°
CBHCACH20H21120.0°120.0°
CBHCACH20H22120.0°120.0°
CBHCACH21H22120.0°120.0°
CACCBHCADH2363.3°175.6°
CACCBHCADH2456.8°55.6°
CACCBHCADH25176.8°64.4°
CACCBHCABH2655.4°60.0°
CACCBHCABH2764.6°60.0°
CACCBHCABH28175.4°180.0°
CADCBHCBFH1952.6°64.8°
CADCBHCACH2062.9°60.0°
CADCBHCACH21177.1°59.9°
CADCBHCACH2257.1°180.0°
CBHCADH23H24120.0°120.1°
CBHCADH23H25120.0°120.0°
CBHCADH24H25120.0°120.0°
CADCBHCABH2661.8°180.0°
CADCBHCABH27178.2°60.0°
CADCBHCABH2858.2°60.0°
NAUCAWOAECAO174.2°179.9°
NAUCAWCAOOAH176.0°180.0°
CAWNAUCBFH198.9°35.0°
NAUCAWCAOH3064.7°60.0°
NAUCAWCAOH3156.8°60.0°
OAECAWCAOOAH1.1°0.1°
OAECAWNAUH29173.7°179.9°
OAECAWCAOH30120.4°120.1°
OAECAWCAOH31118.1°119.9°
CAWCAOOAHH30119.2°120.0°
CAWCAOOAHH31119.2°120.0°
CAOCAWNAUH291.0°0.0°
CAWCAOH30H31122.2°120.0°
CAWCAOOAHH320.5°180.0°
OAHCAOH30H31122.2°120.0°
H1CAAH2H3120.0°120.0°
H5CAMCAKH60.0°0.0°
H7CALCAJH80.0°0.0°
H9CAPNATH1135.6°120.0°
H10CAPNATH11155.3°120.0°
H12CACBH13145.1°144.3°
H12CACBH1424.1°21.1°
H13CBCGH1530.4°35.3°
H14CBCGH1590.6°88.0°
H15CGOD1H1657.8°56.1°
H15CGCD2H1729.1°36.2°
H15CGCD2H1892.1°85.9°
H19CBFNAUH29171.1°145.0°
H20CACH21H22120.0°120.0°
H23CADH24H25119.9°119.9°
H26CABH27H28119.9°120.0°
H30CAOOAHH32119.7°60.0°
H31CAOOAHH32118.7°60.0°

222926

PDB entries from 2024-07-24

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