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MXM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAWCAVsing1.51Å1.51Å
CAVSATsing1.76Å1.68ÅAromatic
CAVCAUdoub1.33Å1.33ÅAromatic
SATCARsing1.71Å1.68ÅAromatic
CAUNASsing1.32Å1.34ÅAromatic
NASCARdoub1.30Å1.35ÅAromatic
CARNAPsing1.39Å1.32Å
NAPCANsing1.35Å1.34Å
CANOAQdoub1.22Å1.22Å
CANCAGsing1.42Å1.38Å
CAGCACdoub1.35Å1.43Å
CAGNAJsing1.41Å1.40Å
CACOAHsing1.35Å1.37Å
CACCAAsing1.47Å1.40Å
CAACADdoub1.40Å1.40ÅAromatic
CAACABsing1.40Å1.37ÅAromatic
CADCAIsing1.38Å1.39ÅAromatic
CAICAMdoub1.38Å1.39ÅAromatic
CAMCAFsing1.39Å1.39ÅAromatic
CAFCABdoub1.37Å1.37ÅAromatic
CABSAEsing1.77Å1.58Å
SAEOAKdoub1.42Å1.54Å
SAEOALdoub1.42Å1.57Å
SAENAJsing1.67Å1.36Å
NAJCAOsing1.46Å1.50Å
CAWH1sing1.09Å1.10Å
CAWH2sing1.09Å1.10Å
CAWH3sing1.09Å1.10Å
CAUH4sing1.08Å1.08Å
NAPH5sing0.97Å1.00Å
OAHH7sing0.97Å0.95Å
CADH8sing1.08Å1.08Å
CAIH9sing1.08Å1.08Å
CAMH10sing1.08Å1.08Å
CAFH11sing1.08Å1.08Å
CAOH14sing1.09Å1.10Å
CAOH15sing1.09Å1.10Å
CAOH16sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAWCAVSAT127.2°126.0°
CAWCAVCAU121.9°126.0°
CAVCAWH1109.5°109.4°
CAVCAWH2109.5°109.5°
CAVCAWH3109.4°109.4°
SATCAVCAU110.9°108.1°
CAVSATCAR94.0°90.4°
CAVCAUNAS110.5°114.6°
CAVCAUH4124.7°122.7°
SATCARNAS105.2°110.1°
SATCARNAP131.3°125.0°
CAUNASCAR118.6°116.9°
NASCAUH4124.7°122.8°
NASCARNAP120.2°125.0°
CARNAPCAN115.2°120.0°
CARNAPH5122.4°120.0°
NAPCANOAQ125.3°120.0°
NAPCANCAG119.5°120.0°
CANNAPH5122.4°120.0°
OAQCANCAG115.0°120.0°
CANCAGCAC125.1°118.8°
CANCAGNAJ117.2°118.8°
CACCAGNAJ116.1°122.4°
CAGCACOAH119.3°117.8°
CAGCACCAA124.6°124.3°
CAGNAJSAE103.9°117.4°
CAGNAJCAO107.1°121.3°
OAHCACCAA115.6°117.9°
CACOAHH7109.5°113.9°
CACCAACAD120.2°120.3°
CACCAACAB116.3°120.7°
CADCAACAB120.4°119.0°
CAACADCAI116.3°119.8°
CAACADH8121.8°120.1°
CAACABCAF121.8°120.7°
CAACABSAE109.5°118.2°
CADCAICAM121.3°120.5°
CAICADH8121.9°120.1°
CADCAIH9119.4°119.7°
CAICAMCAF121.2°120.2°
CAMCAIH9119.4°119.8°
CAICAMH10119.4°120.0°
CAMCAFCAB116.5°119.8°
CAFCAMH10119.4°119.9°
CAMCAFH11121.7°120.1°
CAFCABSAE125.8°121.0°
CABCAFH11121.7°120.1°
CABSAEOAK107.2°106.8°
CABSAEOAL115.3°106.8°
CABSAENAJ113.7°104.4°
OAKSAEOAL102.4°123.6°
OAKSAENAJ102.8°106.7°
OALSAENAJ113.6°107.1°
SAENAJCAO135.5°121.3°
NAJCAOH14109.5°109.4°
NAJCAOH15109.5°109.5°
NAJCAOH16109.5°109.5°
H1CAWH2109.5°109.5°
H1CAWH3109.5°109.5°
H2CAWH3109.5°109.5°
H14CAOH15109.5°109.5°
H14CAOH16109.4°109.4°
H15CAOH16109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAWCAVSATCAU179.2°179.7°
CAWCAVSATCAR175.9°180.0°
CAWCAVCAUNAS179.6°180.0°
CAVCAWH1H2120.0°120.0°
CAVCAWH1H3120.0°120.0°
CAVCAWH2H3120.0°120.0°
CAWCAVCAUH40.4°0.0°
SATCAVCAUNAS0.3°0.3°
CAVSATCARNAS7.7°0.2°
CAVSATCARNAP166.5°179.9°
SATCAVCAWH10.0°0.0°
SATCAVCAWH2120.0°120.0°
SATCAVCAWH3120.0°120.0°
SATCAVCAUH4179.6°179.8°
CAUCAVSATCAR4.9°0.3°
CAVCAUNASH4180.0°180.0°
CAVCAUNASCAR6.3°0.1°
CAUCAVCAWH1179.2°179.7°
CAUCAVCAWH259.1°60.3°
CAUCAVCAWH360.9°59.7°
SATCARNASCAU9.4°0.1°
SATCARNASNAP161.7°179.9°
SATCARNAPCAN179.5°180.0°
SATCARNAPH50.5°0.1°
CAUNASCARNAP171.1°180.0°
NASCARNAPCAN24.2°0.1°
CARNASCAUH4173.8°179.9°
NASCARNAPH5155.7°179.8°
CARNAPCANH5180.0°179.9°
CARNAPCANOAQ5.2°8.1°
CARNAPCANCAG179.9°171.9°
NAPCANOAQCAG175.0°179.9°
NAPCANCAGCAC11.3°171.6°
NAPCANCAGNAJ175.9°8.7°
OAQCANCAGCAC173.5°8.5°
OAQCANCAGNAJ8.8°171.2°
OAQCANNAPH5174.8°171.8°
CANCAGCACNAJ164.8°179.7°
CANCAGCACOAH10.4°0.2°
CANCAGCACCAA178.5°179.7°
CANCAGNAJSAE147.7°149.6°
CANCAGNAJCAO64.6°30.1°
CAGCANNAPH50.0°8.2°
CAGCACOAHCAA171.9°180.0°
CAGCACCAACAD160.1°163.9°
CAGCACCAACAB0.1°16.0°
CACCAGNAJSAE46.2°30.6°
CACCAGNAJCAO101.4°149.6°
CAGCACOAHH7180.0°180.0°
NAJCAGCACOAH175.2°180.0°
NAJCAGCACCAA13.7°0.0°
CAGNAJSAECAB68.7°39.3°
CAGNAJSAEOAK175.8°152.2°
CAGNAJSAEOAL65.9°73.8°
CAGNAJSAECAO133.1°179.8°
CAGNAJCAOH14132.2°0.1°
CAGNAJCAOH1512.1°119.9°
CAGNAJCAOH16107.9°120.0°
OAHCACCAACAD28.4°16.1°
OAHCACCAACAB171.4°164.0°
CACCAACADCAB159.4°179.9°
CACCAACADCAI173.1°180.0°
CACCAACABCAF179.7°179.9°
CACCAACABSAE18.0°0.3°
CAACACOAHH78.1°0.1°
CACCAACADH86.9°0.2°
CAACADCAIH8180.0°179.9°
CAACADCAICAM4.2°0.1°
CADCAACABCAF20.1°0.0°
CADCAACABSAE178.2°179.8°
CAACADCAIH9175.8°180.0°
CABCAACADCAI13.7°0.1°
CAACABCAFCAM15.5°0.0°
CAACABCAFSAE158.6°179.8°
CAACABSAEOAK169.8°137.4°
CAACABSAEOAL76.9°88.5°
CAACABSAENAJ56.9°24.7°
CABCAACADH8166.3°179.9°
CAACABCAFH11164.5°180.0°
CADCAICAMH9180.0°179.9°
CADCAICAMCAF0.5°0.1°
CADCAICAMH10179.5°180.0°
CAICAMCAFH10180.0°179.9°
CAICAMCAFCAB5.7°0.0°
CAMCAICADH8175.8°180.0°
CAICAMCAFH11174.3°179.9°
CAMCAFCABH11180.0°179.9°
CAMCAFCABSAE174.1°179.8°
CAFCAMCAIH9179.6°180.0°
CAFCABSAEOAK29.4°42.7°
CAFCABSAEOAL83.9°91.3°
CAFCABSAENAJ142.3°155.5°
CABCAFCAMH10174.3°180.0°
CABSAEOAKOAL121.8°124.3°
CABSAEOAKNAJ120.2°111.2°
CABSAEOALNAJ133.9°111.4°
CABSAENAJCAO64.4°140.9°
SAECABCAFH115.9°0.1°
OAKSAEOALNAJ110.1°124.3°
OAKSAENAJCAO51.1°28.0°
OALSAENAJCAO160.9°106.0°
SAENAJCAOH140.0°179.8°
SAENAJCAOH15120.0°59.8°
SAENAJCAOH16120.0°60.3°
NAJCAOH14H15120.0°120.0°
NAJCAOH14H16120.0°120.0°
NAJCAOH15H16120.0°120.1°
H1CAWH2H3120.0°120.1°
H8CADCAIH94.2°0.1°
H9CAICAMH100.4°0.0°
H10CAMCAFH115.7°0.0°
H14CAOH15H16120.0°120.0°

218853

PDB entries from 2024-04-24

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