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F9S

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OABCBAsing1.36Å1.43Å
CBACAIdoub1.39Å1.39ÅAromatic
CBACBCsing1.39Å1.41ÅAromatic
CAICAJsing1.38Å1.41ÅAromatic
CAROAAsing1.43Å1.40Å
CARCBCsing1.51Å1.51Å
CBCCAKdoub1.37Å1.40ÅAromatic
CAJCBBdoub1.40Å1.40ÅAromatic
CAKCBBsing1.40Å1.40ÅAromatic
CBBCBDsing1.47Å1.53Å
CBDOACdoub1.21Å1.20Å
CBDCAWsing1.51Å1.56Å
CAWNAXsing1.47Å1.45Å
NAXCASsing1.47Å1.47Å
CASCANsing1.53Å1.55Å
CANCALsing1.53Å1.58Å
CAVCAZsing1.51Å1.50Å
CAVCAQsing1.53Å1.55Å
CAGCAZdoub1.38Å1.38ÅAromatic
CAGCAEsing1.38Å1.40ÅAromatic
CALCAMsing1.53Å1.52Å
CAZCAHsing1.38Å1.39ÅAromatic
CAECADdoub1.38Å1.38ÅAromatic
CAQCAPsing1.53Å1.54Å
CAMCAOsing1.53Å1.50Å
CAHCAFdoub1.38Å1.39ÅAromatic
CADCAFsing1.38Å1.38ÅAromatic
CAPCAUsing1.53Å1.56Å
OAYCAUsing1.43Å1.43Å
OAYCATsing1.43Å1.43Å
CAOCATsing1.53Å1.55Å
CAGH1sing1.08Å1.08Å
CAEH2sing1.08Å1.08Å
CADH3sing1.08Å1.08Å
CAFH4sing1.08Å1.08Å
CAHH5sing1.08Å1.08Å
CAVH6sing1.09Å1.10Å
CAVH7sing1.09Å1.10Å
CAQH8sing1.09Å1.10Å
CAQH9sing1.09Å1.10Å
CAPH10sing1.09Å1.10Å
CAPH11sing1.09Å1.10Å
CAUH12sing1.09Å1.10Å
CAUH13sing1.09Å1.10Å
CATH14sing1.09Å1.10Å
CATH15sing1.09Å1.10Å
CAOH16sing1.09Å1.10Å
CAOH17sing1.09Å1.10Å
CAMH18sing1.09Å1.10Å
CAMH19sing1.09Å1.10Å
CALH20sing1.09Å1.10Å
CALH21sing1.09Å1.10Å
CANH22sing1.09Å1.10Å
CANH23sing1.09Å1.10Å
CASH24sing1.09Å1.10Å
CASH25sing1.09Å1.10Å
NAXH26sing1.01Å1.00Å
CAWH28sing1.09Å1.10Å
CAWH29sing1.09Å1.10Å
CAKH30sing1.08Å1.08Å
CAJH31sing1.08Å1.08Å
CAIH32sing1.08Å1.08Å
OABH33sing0.97Å0.95Å
CARH34sing1.09Å1.10Å
CARH35sing1.09Å1.10Å
OAAH36sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OABCBACAI120.4°119.9°
OABCBACBC119.7°119.8°
CBAOABH33109.5°114.0°
CAICBACBC119.9°120.3°
CBACAICAJ119.8°119.9°
CBACAIH32120.1°120.0°
CBACBCCAR119.7°119.9°
CBACBCCAK120.3°120.2°
CAICAJCBB120.3°119.8°
CAICAJH31119.9°120.0°
CAJCAIH32120.1°120.1°
OAACARCBC108.5°109.5°
OAACARH34109.7°109.5°
OAACARH35109.7°109.5°
CAROAAH36109.5°114.0°
CARCBCCAK119.9°119.9°
CBCCARH34109.7°109.4°
CBCCARH35109.7°109.5°
CBCCAKCBB119.6°120.0°
CBCCAKH30120.2°120.0°
CAJCBBCAK120.0°119.7°
CAJCBBCBD119.8°120.1°
CBBCAJH31119.9°120.1°
CAKCBBCBD120.2°120.1°
CBBCAKH30120.2°120.0°
CBBCBDOAC119.7°120.0°
CBBCBDCAW120.2°120.0°
OACCBDCAW120.1°120.0°
CBDCAWNAX110.8°109.4°
CBDCAWH28109.1°109.4°
CBDCAWH29109.1°109.5°
CAWNAXCAS109.2°111.0°
CAWNAXH26109.5°111.0°
NAXCAWH28109.1°109.5°
NAXCAWH29109.1°109.5°
NAXCASCAN109.3°109.5°
NAXCASH24109.5°109.5°
NAXCASH25109.5°109.5°
CASNAXH26109.5°111.0°
CASCANCAL111.8°109.5°
CASCANH22108.9°109.5°
CASCANH23108.9°109.5°
CANCASH24109.5°109.4°
CANCASH25109.5°109.4°
CANCALCAM111.7°109.5°
CANCALH20108.9°109.5°
CANCALH21108.9°109.5°
CALCANH22108.9°109.4°
CALCANH23108.9°109.4°
CAZCAVCAQ111.7°109.5°
CAVCAZCAG119.7°120.0°
CAVCAZCAH120.2°120.0°
CAZCAVH6108.9°109.4°
CAZCAVH7108.9°109.5°
CAVCAQCAP111.3°109.5°
CAQCAVH6108.9°109.5°
CAQCAVH7108.9°109.5°
CAVCAQH8109.0°109.5°
CAVCAQH9109.0°109.5°
CAZCAGCAE119.9°120.0°
CAGCAZCAH120.1°119.9°
CAZCAGH1120.0°119.9°
CAGCAECAD119.9°120.0°
CAECAGH1120.1°120.0°
CAGCAEH2120.0°120.0°
CALCAMCAO111.9°109.5°
CALCAMH18108.8°109.4°
CALCAMH19108.9°109.4°
CAMCALH20108.9°109.4°
CAMCALH21108.9°109.5°
CAZCAHCAF119.8°120.0°
CAZCAHH5120.1°120.0°
CAECADCAF120.0°120.0°
CADCAEH2120.1°120.0°
CAECADH3120.0°120.0°
CAQCAPCAU111.1°109.5°
CAPCAQH8109.0°109.5°
CAPCAQH9109.0°109.5°
CAQCAPH10109.1°109.5°
CAQCAPH11109.0°109.5°
CAMCAOCAT110.6°109.5°
CAMCAOH16109.2°109.5°
CAMCAOH17109.2°109.5°
CAOCAMH18108.9°109.5°
CAOCAMH19108.8°109.5°
CAHCAFCAD120.2°120.0°
CAHCAFH4119.9°120.0°
CAFCAHH5120.1°120.0°
CAFCADH3120.0°120.0°
CADCAFH4119.9°120.0°
CAPCAUOAY108.2°109.5°
CAUCAPH10109.0°109.5°
CAUCAPH11109.1°109.5°
CAPCAUH12109.8°109.5°
CAPCAUH13109.8°109.5°
CAUOAYCAT112.5°114.0°
OAYCAUH12109.8°109.4°
OAYCAUH13109.8°109.5°
OAYCATCAO107.8°109.5°
OAYCATH14109.9°109.5°
OAYCATH15109.9°109.5°
CAOCATH14109.9°109.4°
CAOCATH15109.9°109.4°
CATCAOH16109.2°109.4°
CATCAOH17109.2°109.4°
H6CAVH7109.5°109.5°
H8CAQH9109.5°109.5°
H10CAPH11109.5°109.5°
H12CAUH13109.5°109.5°
H14CATH15109.5°109.5°
H16CAOH17109.5°109.5°
H18CAMH19109.5°109.5°
H20CALH21109.5°109.4°
H22CANH23109.5°109.5°
H24CASH25109.4°109.5°
H28CAWH29109.5°109.5°
H34CARH35109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OABCBACAICBC179.9°179.7°
OABCBACAICAJ179.9°180.0°
OABCBACBCCAR0.2°0.3°
OABCBACBCCAK180.0°180.0°
OABCBACAIH320.1°0.1°
CBACAICAJH32180.0°179.9°
CAICBACBCCAR179.9°179.9°
CAICBACBCCAK0.1°0.3°
CBACAICAJCBB0.1°0.0°
CBACAICAJH31179.9°180.0°
CAICBAOABH33180.0°90.0°
CBCCBACAICAJ0.0°0.3°
CBACBCCAROAA87.6°180.0°
CBACBCCARCAK179.8°179.7°
CBACBCCAKCBB0.2°0.0°
CBACBCCAKH30179.8°180.0°
CBCCBACAIH32180.0°179.7°
CBCCBAOABH330.1°90.3°
CBACBCCARH34152.6°60.0°
CBACBCCARH3532.3°59.9°
CAICAJCBBH31180.0°180.0°
CAICAJCBBCAK0.2°0.3°
CAICAJCBBCBD179.7°180.0°
OAACARCBCH34119.9°120.0°
OAACARCBCH35119.9°120.0°
OAACARCBCCAK92.6°0.3°
OAACARH34H35120.4°120.1°
CARCBCCAKCBB180.0°179.7°
CARCBCCAKH300.0°0.3°
CBCCARH34H35120.4°120.0°
CBCCAROAAH36180.0°180.0°
CBCCAKCBBCAJ0.3°0.3°
CBCCAKCBBH30180.0°180.0°
CBCCAKCBBCBD179.8°180.0°
CAKCBCCARH3427.2°120.3°
CAKCBCCARH35147.5°119.7°
CAJCBBCAKCBD179.5°179.7°
CAJCBBCBDOAC32.7°179.8°
CAJCBBCBDCAW147.6°0.3°
CAJCBBCAKH30179.7°179.8°
CBBCAJCAIH32180.0°179.9°
CAKCBBCBDOAC146.9°0.1°
CAKCBBCBDCAW32.9°180.0°
CAKCBBCAJH31179.8°179.7°
CBBCBDOACCAW179.8°179.9°
CBBCBDCAWNAX144.7°180.0°
CBBCBDCAWH2824.5°60.0°
CBBCBDCAWH2995.1°60.0°
CBDCBBCAKH300.2°0.0°
CBDCBBCAJH310.3°0.0°
OACCBDCAWNAX35.6°0.1°
OACCBDCAWH28155.7°120.0°
OACCBDCAWH2984.7°120.0°
CBDCAWNAXH28120.2°119.9°
CBDCAWNAXH29120.2°120.0°
CBDCAWNAXCAS165.9°180.0°
CBDCAWNAXH2674.2°56.0°
CBDCAWH28H29119.4°120.0°
CAWNAXCASH26120.0°124.0°
CAWNAXCASCAN146.9°180.0°
CAWNAXCASH2493.1°60.0°
CAWNAXCASH2526.9°60.0°
NAXCAWH28H29119.4°120.1°
NAXCASCANH24120.0°120.0°
NAXCASCANH25120.0°120.0°
NAXCASCANCAL171.3°180.0°
NAXCASCANH2268.3°60.0°
NAXCASCANH2351.0°60.0°
NAXCASH24H25120.1°120.0°
CASNAXCAWH2845.7°60.1°
CASNAXCAWH2973.9°60.0°
CASCANCALH22120.4°120.0°
CASCANCALH23120.3°120.0°
CASCANCALCAM88.0°180.0°
CASCANCALH20151.7°60.0°
CASCANCALH2132.4°60.0°
CASCANH22H23118.9°120.0°
CANCASH24H25120.1°119.9°
CANCASNAXH2626.9°56.0°
CANCALCAMH20120.3°120.0°
CANCALCAMH21120.4°120.1°
CANCALCAMCAO163.2°180.0°
CANCALCAMH1876.5°60.0°
CANCALCAMH1942.8°60.0°
CANCALH20H21119.0°120.0°
CALCANH22H23119.0°120.0°
CALCANCASH2451.3°60.0°
CALCANCASH2568.7°60.0°
CAZCAVCAQH6120.4°120.0°
CAZCAVCAQH7120.3°120.0°
CAVCAZCAGCAH179.9°180.0°
CAVCAZCAGCAE179.9°180.0°
CAZCAVCAQCAP60.2°180.0°
CAVCAZCAHCAF179.9°179.9°
CAVCAZCAGH10.1°0.3°
CAVCAZCAHH50.1°0.0°
CAZCAVH6H7119.0°120.0°
CAZCAVCAQH8179.5°60.0°
CAZCAVCAQH960.1°60.0°
CAQCAVCAZCAG120.1°90.0°
CAQCAVCAZCAH60.0°90.0°
CAVCAQCAPH8120.3°120.0°
CAVCAQCAPH9120.3°120.0°
CAVCAQCAPCAU176.8°NaN°
CAQCAVH6H7118.9°120.0°
CAVCAQH8H9119.1°120.0°
CAVCAQCAPH1056.5°60.0°
CAVCAQCAPH1163.0°60.0°
CAZCAGCAEH1180.0°179.7°
CAZCAGCAECAD0.0°0.0°
CAGCAZCAHCAF0.0°0.1°
CAZCAGCAEH2180.0°180.0°
CAGCAZCAHH5180.0°180.0°
CAGCAZCAVH60.3°150.0°
CAGCAZCAVH7119.6°30.0°
CAECAGCAZCAH0.0°0.0°
CAGCAECADH2180.0°180.0°
CAGCAECADCAF0.0°0.0°
CAGCAECADH3180.0°180.0°
CALCAMCAOH18120.4°120.0°
CALCAMCAOH19120.4°120.0°
CALCAMCAOCAT167.7°180.0°
CALCAMCAOH1647.5°60.0°
CALCAMCAOH1772.1°60.0°
CALCAMH18H19118.9°119.9°
CAMCALH20H21119.0°119.9°
CAMCALCANH2232.4°60.0°
CAMCALCANH23151.7°60.0°
CAZCAHCAFH5180.0°179.9°
CAZCAHCAFCAD0.0°0.1°
CAHCAZCAGH1180.0°179.7°
CAZCAHCAFH4180.0°180.0°
CAHCAZCAVH6179.7°30.0°
CAHCAZCAVH760.3°150.0°
CAECADCAFCAH0.0°0.1°
CAECADCAFH3180.0°180.0°
CADCAECAGH1180.0°179.7°
CAECADCAFH4180.0°180.0°
CAQCAPCAUH10120.2°120.1°
CAQCAPCAUH11120.2°120.0°
CAQCAPCAUOAY71.2°180.0°
CAPCAQCAVH660.1°60.0°
CAPCAQCAVH7179.4°60.0°
CAPCAQH8H9119.2°120.0°
CAQCAPH10H11119.2°120.0°
CAQCAPCAUH1248.6°60.0°
CAQCAPCAUH13169.1°60.0°
CAMCAOCATOAY57.6°180.0°
CAMCAOCATH16120.2°120.0°
CAMCAOCATH17120.2°120.0°
CAMCAOCATH14177.3°59.9°
CAMCAOCATH1562.2°60.0°
CAMCAOH16H17119.5°120.0°
CAOCAMH18H19118.9°120.0°
CAOCAMCALH2042.8°59.9°
CAOCAMCALH2176.5°60.0°
CAHCAFCADH4180.0°179.9°
CAHCAFCADH3180.0°180.0°
CAFCADCAEH2180.0°180.0°
CADCAFCAHH5180.0°180.0°
CAPCAUOAYH12119.8°120.0°
CAPCAUOAYH13119.8°120.0°
CAPCAUOAYCAT149.4°180.0°
CAUCAPCAQH862.9°60.0°
CAUCAPCAQH956.5°60.0°
CAUCAPH10H11119.3°120.0°
CAPCAUH12H13120.6°120.0°
CAUOAYCATCAO177.2°180.0°
OAYCAUCAPH10168.6°60.0°
OAYCAUCAPH1149.1°60.0°
OAYCAUH12H13120.6°120.0°
CAUOAYCATH1463.1°60.0°
CAUOAYCATH1557.4°60.0°
OAYCATCAOH14119.8°120.1°
OAYCATCAOH15119.7°120.0°
CATOAYCAUH1290.8°60.0°
CATOAYCAUH1329.6°60.0°
OAYCATH14H15120.7°120.0°
OAYCATCAOH16177.8°60.0°
OAYCATCAOH1762.6°60.0°
CAOCATH14H15120.8°119.9°
CATCAOH16H17119.5°119.9°
CATCAOCAMH1871.9°60.0°
CATCAOCAMH1947.4°60.0°
H1CAGCAEH20.0°0.3°
H2CAECADH30.0°0.0°
H3CADCAFH40.0°0.0°
H4CAFCAHH50.0°0.0°
H6CAVCAQH860.1°179.9°
H6CAVCAQH9179.6°60.0°
H7CAVCAQH859.2°60.0°
H7CAVCAQH960.3°180.0°
H8CAQCAPH10176.8°180.0°
H8CAQCAPH1157.3°60.0°
H9CAQCAPH1063.7°60.0°
H9CAQCAPH11176.8°180.0°
H10CAPCAUH1271.6°179.9°
H10CAPCAUH1348.8°60.0°
H11CAPCAUH12168.9°60.0°
H11CAPCAUH1370.7°180.0°
H14CATCAOH1662.5°180.0°
H14CATCAOH1757.1°60.1°
H15CATCAOH1658.0°60.0°
H15CATCAOH17177.6°180.0°
H16CAOCAMH18167.9°180.0°
H16CAOCAMH1972.8°59.9°
H17CAOCAMH1848.2°60.0°
H17CAOCAMH19167.5°180.0°
H18CAMCALH20163.2°180.0°
H18CAMCALH2143.9°60.1°
H19CAMCALH2077.5°60.0°
H19CAMCALH21163.2°180.0°
H20CALCANH2288.0°180.0°
H20CALCANH2331.3°60.0°
H21CALCANH22152.7°60.0°
H21CALCANH2388.0°180.0°
H22CANCASH24171.7°179.9°
H22CANCASH2551.7°60.0°
H23CANCASH2469.0°60.0°
H23CANCASH25171.0°180.0°
H24CASNAXH26146.9°64.0°
H25CASNAXH2693.1°176.0°
H26NAXCAWH28165.6°63.9°
H26NAXCAWH2946.0°176.1°
H31CAJCAIH320.1°0.0°
H34CAROAAH3660.1°60.0°
H35CAROAAH3660.1°60.0°

222624

PDB entries from 2024-07-17

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