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9LW

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAACAMsing1.53Å1.24Å
CAMOAVsing1.43Å1.28Å
CAJCALdoub1.38Å1.26ÅAromatic
CAJCAYsing1.40Å1.40ÅAromatic
NATCADdoub1.29Å1.15Å
NATOAVsing1.42Å1.34Å
CADCAYsing1.47Å1.38Å
CALCAZsing1.39Å1.41ÅAromatic
CAYCAIdoub1.40Å1.40ÅAromatic
CABCBBsing1.53Å1.33Å
CAZOAWsing1.36Å1.33Å
CAZCAKdoub1.39Å1.39ÅAromatic
CANOAWsing1.43Å1.31Å
CANCAOsing1.53Å1.18Å
CAICAKsing1.38Å1.25ÅAromatic
CAOCBBsing1.53Å1.38Å
CBBCAPsing1.53Å1.39Å
CAPCAQsing1.53Å1.18Å
CARNBCsing1.39Å1.33Å
CARCASdoub1.33Å1.55Å
CAQNBCsing1.47Å1.33Å
NBCCAXsing1.35Å1.45Å
CASNBDsing1.39Å1.33Å
CAXNBDsing1.35Å1.43Å
CAXOACdoub1.22Å1.20Å
NBDCBAsing1.40Å1.39Å
CBACAGdoub1.39Å1.38ÅAromatic
CBACAHsing1.39Å1.42ÅAromatic
CAGCAEsing1.38Å1.28ÅAromatic
CAHCAFdoub1.38Å1.43ÅAromatic
CAENAUdoub1.32Å1.37ÅAromatic
CAFNAUsing1.32Å1.24ÅAromatic
CAAH1sing1.09Å1.10Å
CAAH2sing1.09Å1.10Å
CAMH3sing1.09Å1.10Å
CADH5sing1.08Å1.08Å
CAJH7sing1.08Å1.08Å
CALH8sing1.08Å1.08Å
CAIH9sing1.08Å1.08Å
CAKH10sing1.08Å1.08Å
CANH11sing1.09Å1.10Å
CABH12sing1.09Å1.10Å
CABH13sing1.09Å1.10Å
CABH14sing1.09Å1.10Å
CAPH15sing1.09Å1.10Å
CAPH16sing1.09Å1.10Å
CAQH17sing1.09Å1.10Å
CAQH18sing1.09Å1.10Å
CARH19sing1.08Å1.08Å
CASH20sing1.08Å1.08Å
CAGH21sing1.08Å1.08Å
CAEH22sing1.08Å1.08Å
CAFH26sing1.08Å1.08Å
CAHH28sing1.08Å1.08Å
CAAH30sing1.09Å1.10Å
CAMH31sing1.09Å1.10Å
CANH4sing1.09Å1.10Å
CAOH6sing1.09Å1.10Å
CAOH32sing1.09Å1.10Å
CBBH33sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAACAMOAV147.8°109.5°
CAMCAAH1109.5°109.5°
CAMCAAH2109.5°109.5°
CAACAMH399.2°109.4°
CAMCAAH30109.5°109.4°
CAACAMH3199.2°109.5°
CAMOAVNAT114.5°114.0°
OAVCAMH399.2°109.5°
OAVCAMH3199.2°109.5°
CALCAJCAY125.9°119.9°
CAJCALCAZ129.2°120.1°
CALCAJH7117.0°120.1°
CAJCALH8115.4°120.0°
CAJCAYCAD140.1°120.1°
CAJCAYCAI104.7°119.8°
CAYCAJH7117.0°120.0°
CADNATOAV154.3°120.0°
NATCADCAY157.7°120.0°
NATCADH5101.1°120.0°
CADCAYCAI115.2°120.1°
CAYCADH5101.1°120.0°
CALCAZOAW119.3°119.9°
CALCAZCAK103.7°120.2°
CAZCALH8115.4°120.0°
CAYCAICAK128.7°119.9°
CAYCAIH9115.6°120.1°
CABCBBCAO107.4°109.5°
CABCBBCAP104.6°109.5°
CBBCABH12109.5°109.5°
CBBCABH13109.5°109.5°
CBBCABH14109.4°109.5°
CABCBBH3397.8°109.5°
OAWCAZCAK137.0°119.9°
CAZOAWCAN121.5°116.9°
CAZCAKCAI127.6°120.1°
CAZCAKH10116.2°119.9°
OAWCANCAO152.0°109.4°
OAWCANH1198.0°109.5°
OAWCANH498.0°109.5°
CANCAOCBB160.5°109.5°
CAOCANH1198.0°109.4°
CAOCANH498.0°109.5°
CANCAOH695.6°109.5°
CANCAOH3295.6°109.5°
CAKCAIH9115.6°120.0°
CAICAKH10116.2°120.0°
CAOCBBCAP142.2°109.5°
CBBCAOH695.6°109.4°
CBBCAOH3295.6°109.5°
CAOCBBH3397.6°109.4°
CBBCAPCAQ153.3°109.5°
CBBCAPH1597.7°109.5°
CBBCAPH1697.7°109.4°
CAPCBBH3397.5°109.5°
CAPCAQNBC168.5°109.5°
CAQCAPH1597.6°109.5°
CAQCAPH1697.6°109.5°
CAPCAQH1793.3°109.5°
CAPCAQH1893.3°109.5°
NBCCARCAS103.4°107.9°
CARNBCCAQ133.7°125.9°
CARNBCCAX113.7°108.1°
NBCCARH19128.3°126.1°
CARCASNBD107.9°107.9°
CASCARH19128.3°126.0°
CARCASH20126.0°126.0°
CAQNBCCAX112.6°126.0°
NBCCAQH1793.3°109.4°
NBCCAQH1893.3°109.5°
NBCCAXNBD103.8°108.1°
NBCCAXOAC129.0°126.0°
CASNBDCAX111.2°108.0°
CASNBDCBA138.9°126.0°
NBDCASH20126.1°126.1°
NBDCAXOAC127.2°125.9°
CAXNBDCBA109.9°126.0°
NBDCBACAG125.3°120.8°
NBDCBACAH119.9°120.8°
CAGCBACAH108.6°118.3°
CBACAGCAE131.6°119.0°
CBACAGH21114.2°120.5°
CBACAHCAF119.2°119.0°
CBACAHH28120.4°120.5°
CAGCAENAU110.1°120.9°
CAECAGH21114.2°120.5°
CAGCAEH22125.0°119.6°
CAHCAFNAU114.5°120.8°
CAHCAFH26122.7°119.6°
CAFCAHH28120.4°120.5°
CAENAUCAF129.4°121.9°
NAUCAEH22125.0°119.6°
NAUCAFH26122.8°119.6°
H1CAAH2109.5°109.5°
H1CAAH30109.5°109.4°
H2CAAH30109.5°109.5°
H3CAMH31109.5°109.4°
H11CANH4109.5°109.5°
H12CABH13109.4°109.4°
H12CABH14109.5°109.4°
H13CABH14109.5°109.5°
H15CAPH16109.5°109.5°
H17CAQH18109.5°109.5°
H6CAOH32109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAACAMOAVH3124.2°120.0°
CAACAMOAVH31124.2°120.1°
CAACAMOAVNAT44.8°180.0°
CAMCAAH1H2120.0°120.1°
CAMCAAH1H30120.0°119.9°
CAMCAAH2H30120.0°119.9°
CAACAMH3H31103.3°120.0°
CAMOAVNATCAD116.4°179.9°
OAVCAMCAAH1180.0°180.0°
OAVCAMCAAH260.0°59.9°
OAVCAMH3H31103.2°120.0°
OAVCAMCAAH3060.0°60.0°
CALCAJCAYH7180.0°179.9°
CALCAJCAYCAD179.3°180.0°
CAJCALCAZH8180.0°179.9°
CALCAJCAYCAI1.0°0.3°
CAJCALCAZOAW179.3°180.0°
CAJCALCAZCAK1.3°0.4°
CAJCAYCADNAT26.2°171.5°
CAJCAYCADCAI179.6°179.7°
CAYCAJCALCAZ1.8°0.0°
CAJCAYCAICAK0.3°0.3°
CAJCAYCADH5153.8°8.4°
CAYCAJCALH8178.2°179.9°
CAJCAYCAIH9179.7°179.7°
NATCADCAYH5180.0°179.9°
NATCADCAYCAI153.5°8.8°
OAVNATCADCAY80.5°9.8°
NATOAVCAMH379.4°60.0°
OAVNATCADH599.5°170.1°
NATOAVCAMH31169.0°60.0°
CADCAYCAICAK179.9°180.0°
CADCAYCAJH70.7°0.1°
CADCAYCAIH90.1°0.0°
CALCAZOAWCAK179.1°179.6°
CALCAZOAWCAN132.1°180.0°
CALCAZCAKCAI0.6°0.4°
CAZCALCAJH7178.2°179.9°
CALCAZCAKH10179.4°179.7°
CAYCAICAKCAZ0.2°0.0°
CAYCAICAKH9180.0°180.0°
CAICAYCADH526.5°171.3°
CAICAYCAJH7179.0°179.8°
CAYCAICAKH10179.8°180.0°
CABCBBCAOCAN16.0°65.0°
CABCBBCAOCAP146.7°120.0°
CABCBBCAOH33100.6°120.0°
CABCBBCAPH33100.1°120.1°
CABCBBCAPCAQ0.8°65.0°
CBBCABH12H13120.0°120.0°
CBBCABH12H14120.0°120.0°
CBBCABH13H14120.0°120.0°
CABCBBCAPH15123.8°55.0°
CABCBBCAPH16125.3°175.0°
CABCBBCAOH6108.9°55.1°
CABCBBCAOH32140.8°175.0°
CAZOAWCANCAO114.6°180.0°
OAWCAZCAKCAI179.8°180.0°
OAWCAZCALH80.7°0.1°
OAWCAZCAKH100.2°0.0°
CAZOAWCANH119.9°60.1°
CAZOAWCANH4121.0°60.0°
CAKCAZOAWCAN47.0°0.3°
CAZCAKCAIH10180.0°180.0°
CAKCAZCALH8178.6°179.7°
CAZCAKCAIH9179.8°180.0°
OAWCANCAOH11124.5°119.9°
OAWCANCAOH4124.4°120.0°
OAWCANCAOCBB146.4°180.0°
OAWCANH11H4101.5°120.1°
OAWCANCAOH621.5°60.0°
OAWCANCAOH3288.8°59.9°
CANCAOCBBH6124.9°120.0°
CANCAOCBBH32124.9°120.1°
CANCAOCBBCAP162.6°175.0°
CAOCANH11H4101.5°120.0°
CANCAOH6H3298.0°120.0°
CANCAOCBBH3384.7°55.0°
CAOCBBCAPH33112.7°119.9°
CAOCBBCAPCAQ147.9°175.0°
CBBCAOCANH1189.2°60.0°
CAOCBBCABH12180.0°60.0°
CAOCBBCABH1360.0°60.0°
CAOCBBCABH1460.0°179.9°
CAOCBBCAPH1523.4°65.0°
CAOCBBCAPH1687.5°55.0°
CBBCAOCANH421.9°60.0°
CBBCAOH6H3298.0°120.0°
CBBCAPCAQH15124.5°120.0°
CBBCAPCAQH16124.6°119.9°
CBBCAPCAQNBC69.1°180.0°
CAPCBBCABH1220.4°180.0°
CAPCBBCABH13140.3°60.0°
CAPCBBCABH1499.7°60.1°
CBBCAPH15H16101.0°119.9°
CBBCAPCAQH17165.8°60.0°
CBBCAPCAQH1856.1°60.0°
CAPCBBCAOH637.8°65.0°
CAPCBBCAOH3272.5°55.0°
CAPCAQNBCCAR118.4°90.3°
CAPCAQNBCH17125.1°120.1°
CAPCAQNBCH18125.1°120.0°
CAPCAQNBCCAX61.0°90.0°
CAQCAPH15H16100.9°120.1°
CAPCAQH17H1894.7°120.0°
CAQCAPCBBH3399.4°55.0°
NBCCARCASH19180.0°180.0°
CARNBCCAQCAX179.4°179.7°
NBCCARCASNBD0.0°0.1°
CARNBCCAXNBD0.3°0.3°
CARNBCCAXOAC180.0°179.7°
CARNBCCAQH17116.4°149.7°
CARNBCCAQH186.7°29.7°
NBCCARCASH20180.0°180.0°
CASCARNBCCAQ179.6°180.0°
CASCARNBCCAX0.1°0.3°
CARCASNBDH20180.0°179.8°
CARCASNBDCAX0.2°0.0°
CARCASNBDCBA179.7°179.8°
CAQNBCCAXNBD179.8°179.9°
CAQNBCCAXOAC0.5°0.1°
NBCCAQCAPH1555.5°60.0°
NBCCAQCAPH16166.4°60.0°
NBCCAQH17H1894.7°120.0°
CAQNBCCARH190.5°0.0°
NBCCAXNBDCAS0.3°0.2°
NBCCAXNBDOAC179.7°180.0°
NBCCAXNBDCBA179.9°180.0°
CAXNBCCAQH1764.1°30.1°
CAXNBCCAQH18173.9°150.0°
CAXNBCCARH19179.9°179.8°
CASNBDCAXCBA179.7°179.8°
CASNBDCAXOAC180.0°179.8°
CASNBDCBACAG44.0°0.2°
CASNBDCBACAH105.1°179.9°
NBDCASCARH19180.0°179.9°
CAXNBDCBACAG135.5°180.0°
CAXNBDCBACAH75.4°0.3°
CAXNBDCASH20179.8°179.8°
OACCAXNBDCBA0.4°0.0°
NBDCBACAGCAH152.0°179.7°
NBDCBACAGCAE161.5°180.0°
NBDCBACAHCAF179.6°179.7°
CBANBDCASH200.3°0.0°
NBDCBACAGH2118.5°0.1°
NBDCBACAHH280.4°0.0°
CBACAGCAEH21180.0°179.9°
CAGCBACAHCAF26.6°0.6°
CBACAGCAENAU10.4°0.0°
CBACAGCAEH22169.6°180.0°
CAGCBACAHH28153.4°179.7°
CAHCBACAGCAE9.6°0.3°
CBACAHCAFH28180.0°179.7°
CBACAHCAFNAU23.5°0.6°
CAHCBACAGH21170.4°179.8°
CBACAHCAFH26156.5°179.7°
CAGCAENAUH22180.0°179.9°
CAGCAENAUCAF16.1°0.0°
CAHCAFNAUCAE0.1°0.3°
CAHCAFNAUH26180.0°179.7°
NAUCAECAGH21169.6°179.9°
CAENAUCAFH26179.9°180.0°
CAFNAUCAEH22163.8°180.0°
NAUCAFCAHH28156.5°179.7°
H1CAAH2H30120.0°120.0°
H1CAACAMH355.8°60.0°
H1CAACAMH3155.8°59.9°
H2CAACAMH364.2°60.1°
H2CAACAMH31175.8°180.0°
H3CAMCAAH30175.8°180.0°
H7CAJCALH81.8°0.0°
H9CAICAKH100.2°0.0°
H11CANCAOH6145.9°180.0°
H11CANCAOH3235.7°60.0°
H12CABH13H14120.0°120.0°
H12CABCBBH3379.5°59.9°
H13CABCBBH3340.5°179.9°
H14CABCBBH33160.5°60.0°
H15CAPCAQH1769.7°180.0°
H15CAPCAQH18179.4°60.0°
H15CAPCBBH33136.1°175.1°
H16CAPCAQH1741.2°60.0°
H16CAPCAQH1868.5°180.0°
H16CAPCBBH3325.2°65.0°
H19CARCASH200.0°0.1°
H21CAGCAEH2210.4°0.0°
H26CAFCAHH2823.5°0.0°
H30CAACAMH3164.2°60.0°
H4CANCAOH6103.0°60.0°
H4CANCAOH32146.8°180.0°
H6CAOCBBH33150.4°175.0°
H32CAOCBBH3340.2°65.0°

219869

PDB entries from 2024-05-15

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