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Obsolete: MDG

MDG was replaced with M7G on
Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
PBO1Bdoub1.48Å1.62Å
PBO2Bsing1.61Å1.49Å
PBO3Bsing1.61Å1.48Å
PBO3Asing1.61Å1.62Å
O2BHOB2sing0.97Å0.95Å
O3BHOB3sing0.97Å0.95Å
O3APAsing1.61Å1.62Å
PAO1Adoub1.48Å1.49Å
PAO2Asing1.61Å1.49Å
PAO5'sing1.61Å1.61Å
O2AHOA2sing0.97Å0.95Å
O5'C5'sing1.43Å1.44Å
C5'C4'sing1.53Å1.53Å
C5'H5'1sing1.09Å1.11Å
C5'H5'2sing1.09Å1.12Å
C4'O4'sing1.44Å1.42Å
C4'C3'sing1.54Å1.52Å
C4'H4'sing1.09Å1.12Å
O4'C1'sing1.44Å1.44Å
C3'O3'sing1.43Å1.44Å
C3'C2'sing1.55Å1.52Å
C3'H3'sing1.09Å1.11Å
O3'HO3'sing0.97Å0.95Å
C2'O2'sing1.43Å1.43Å
C2'C1'sing1.54Å1.53Å
C2'H2'sing1.09Å1.11Å
O2'HO2'sing0.97Å0.95Å
C1'N9sing1.46Å1.48Å
C1'H1'sing1.09Å1.12Å
N9C8sing1.47Å1.37Å
N9C4sing1.38Å1.38Å
C8N7sing1.47Å1.29Å
C8H81sing1.09Å1.12Å
C8H82sing1.09Å1.11Å
N7CM7sing1.46Å1.44Å
N7C5sing1.41Å1.39Å
CM7HM71sing1.09Å1.11Å
CM7HM72sing1.09Å1.12Å
CM7HM73sing1.09Å1.11Å
C5C6sing1.40Å1.41Å
C5C4doub1.39Å1.37Å
C6O6doub1.22Å1.22Å
C6N1sing1.35Å1.38Å
N1C2sing1.36Å1.38Å
N1HN1sing0.97Å1.02Å
C2N2sing1.37Å1.33Å
C2N3doub1.31Å1.34Å
N2HN21sing0.97Å1.02Å
N2HN22sing0.97Å1.02Å
N3C4sing1.34Å1.36Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1BPBO2B106.4°109.4°
O1BPBO3B109.3°109.5°
O1BPBO3A108.3°109.5°
O2BPBO3B118.4°109.5°
O2BPBO3A105.8°109.5°
PBO2BHOB2106.5°106.8°
O3BPBO3A108.3°109.5°
PBO3BHOB3109.3°106.8°
PBO3APA125.3°106.8°
O3APAO1A110.0°109.5°
O3APAO2A107.9°109.5°
O3APAO5'104.1°109.4°
O1APAO2A117.4°109.5°
O1APAO5'108.8°109.4°
O2APAO5'107.8°109.5°
PAO2AHOA2107.9°106.9°
PAO5'C5'123.0°106.8°
O5'C5'C4'113.3°109.5°
O5'C5'H5'1110.8°109.5°
O5'C5'H5'2110.8°109.4°
C4'C5'H5'1110.8°109.5°
C4'C5'H5'2110.8°109.5°
C5'C4'O4'110.3°110.3°
C5'C4'C3'111.5°110.5°
C5'C4'H4'106.0°110.3°
H5'1C5'H5'299.4°109.4°
O4'C4'C3'104.4°104.8°
O4'C4'H4'113.0°110.4°
C4'O4'C1'106.4°105.2°
C3'C4'H4'111.7°110.4°
C4'C3'O3'110.8°110.5°
C4'C3'C2'103.4°104.1°
C4'C3'H3'112.9°110.5°
O4'C1'C2'108.8°104.9°
O4'C1'N9106.4°110.4°
O4'C1'H1'113.7°110.4°
O3'C3'C2'110.4°110.6°
O3'C3'H3'106.2°110.5°
C3'O3'HO3'110.8°106.8°
C2'C3'H3'113.3°110.5°
C3'C2'O2'112.7°110.5°
C3'C2'C1'102.4°104.0°
C3'C2'H2'111.1°110.5°
O2'C2'C1'106.6°110.8°
O2'C2'H2'107.2°110.5°
C2'O2'HO2'112.8°106.8°
C1'C2'H2'116.8°110.5°
C2'C1'N9114.3°110.4°
C2'C1'H1'105.7°110.4°
N9C1'H1'108.1°110.3°
C1'N9C8128.6°126.1°
C1'N9C4125.6°126.1°
C8N9C4105.5°107.8°
N9C8N7114.0°105.6°
N9C8H81110.5°110.2°
N9C8H82110.5°110.2°
N9C4C5105.6°110.0°
N9C4N3126.6°130.6°
N7C8H81110.6°110.2°
N7C8H82110.6°110.2°
C8N7CM7124.5°126.7°
C8N7C5104.0°106.7°
H81C8H8299.7°110.3°
CM7N7C5131.5°126.6°
N7CM7HM71124.5°109.5°
N7CM7HM72106.9°109.5°
N7CM7HM73106.9°109.5°
N7C5C6129.9°131.3°
N7C5C4110.8°109.8°
HM71CM7HM72106.9°109.4°
HM71CM7HM73107.0°109.5°
HM72CM7HM73102.7°109.5°
C6C5C4119.2°118.9°
C5C6O6128.3°120.6°
C5C6N1112.3°118.9°
C5C4N3127.8°119.4°
O6C6N1119.4°120.5°
C6N1C2125.8°120.0°
C6N1HN1117.1°120.0°
C2N1HN1117.1°120.0°
N1C2N2117.7°119.2°
N1C2N3121.9°121.5°
N2C2N3120.3°119.3°
C2N2HN21117.7°120.0°
C2N2HN22109.3°120.0°
C2N3C4113.0°121.3°
HN21N2HN22109.3°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1BPBO2BO3B123.4°120.0°
O1BPBO2BO3A115.1°120.0°
O1BPBO3BO3A117.8°120.0°
O1BPBO2BHOB2180.0°60.0°
O1BPBO3BHOB3180.0°180.0°
O1BPBO3APA99.9°60.1°
O2BPBO3BO3A120.3°120.0°
O2BPBO3BHOB358.0°60.0°
O2BPBO3APA146.3°180.0°
O3BPBO2BHOB256.6°60.0°
O3BPBO3APA18.5°60.0°
O3APBO2BHOB264.9°180.0°
O3APBO3BHOB362.3°60.0°
PBO3APAO1A54.5°60.1°
PBO3APAO2A74.7°60.0°
PBO3APAO5'170.9°180.0°
O3APAO1AO2A123.9°120.0°
O3APAO1AO5'113.5°119.9°
O3APAO2AO5'111.9°119.9°
O3APAO2AHOA2180.0°60.0°
O3APAO5'C5'50.9°180.0°
O1APAO2AO5'123.2°120.0°
O1APAO2AHOA255.0°180.0°
O1APAO5'C5'66.4°60.1°
O2APAO5'C5'165.3°60.0°
O5'PAO2AHOA268.1°60.0°
PAO5'C5'C4'101.0°180.0°
PAO5'C5'H5'1133.7°59.9°
PAO5'C5'H5'224.3°60.0°
O5'C5'C4'H5'1125.3°120.1°
O5'C5'C4'H5'2125.3°120.0°
O5'C5'H5'1H5'2116.7°119.9°
O5'C5'C4'O4'56.6°61.4°
O5'C5'C4'C3'59.0°176.9°
O5'C5'C4'H4'179.2°60.8°
C4'C5'H5'1H5'2116.6°120.0°
C5'C4'O4'C3'119.9°119.0°
C5'C4'O4'H4'118.4°122.2°
C5'C4'C3'H4'118.5°122.3°
C5'C4'O4'C1'155.6°159.5°
C5'C4'C3'O3'84.4°98.3°
C5'C4'C3'C2'157.3°142.9°
C5'C4'C3'H3'34.5°24.2°
H5'1C5'C4'O4'178.1°178.5°
H5'1C5'C4'C3'66.4°63.1°
H5'1C5'C4'H4'55.5°59.2°
H5'2C5'C4'O4'68.7°58.5°
H5'2C5'C4'C3'175.7°56.9°
H5'2C5'C4'H4'53.9°179.2°
O4'C4'C3'H4'122.4°118.9°
O4'C4'C3'O3'156.5°142.8°
O4'C4'C3'C2'38.2°24.1°
O4'C4'C3'H3'84.5°94.6°
C4'O4'C1'C2'19.4°40.5°
C4'O4'C1'N9143.1°159.4°
C4'O4'C1'H1'98.0°78.4°
C3'C4'O4'C1'35.7°40.5°
C4'C3'O3'C2'114.0°114.7°
C4'C3'O3'H3'122.9°122.6°
C4'C3'C2'H3'122.5°118.7°
C4'C3'O3'HO3'180.0°180.0°
C4'C3'C2'O2'88.9°118.8°
C4'C3'C2'C1'25.2°0.1°
C4'C3'C2'H2'150.7°118.6°
H4'C4'O4'C1'85.9°78.3°
H4'C4'C3'O3'34.1°23.9°
H4'C4'C3'C2'84.2°94.8°
H4'C4'C3'H3'153.0°146.5°
O4'C1'C2'C3'4.7°23.9°
O4'C1'C2'O2'113.9°142.6°
O4'C1'C2'N9118.7°118.9°
O4'C1'C2'H1'122.5°118.9°
O4'C1'C2'H2'126.3°94.7°
O4'C1'N9H1'122.5°122.2°
O4'C1'N9C841.3°123.0°
O4'C1'N9C4132.3°57.0°
O3'C3'C2'H3'118.9°122.6°
O3'C3'C2'O2'29.7°0.1°
O3'C3'C2'C1'143.8°118.8°
O3'C3'C2'H2'90.7°122.7°
C2'C3'O3'HO3'66.0°65.3°
C3'C2'O2'C1'111.6°114.6°
C3'C2'O2'H2'122.6°122.6°
C3'C2'C1'H2'121.6°118.6°
C3'C2'O2'HO2'179.9°61.5°
C3'C2'C1'N9114.1°142.8°
C3'C2'C1'H1'127.1°95.0°
H3'C3'O3'HO3'57.1°57.4°
H3'C3'C2'O2'148.6°122.6°
H3'C3'C2'C1'97.3°118.6°
H3'C3'C2'H2'28.2°0.1°
O2'C2'C1'H2'119.8°122.8°
O2'C2'C1'N9127.3°98.6°
O2'C2'C1'H1'8.5°23.6°
C1'C2'O2'HO2'68.4°176.1°
C2'C1'N9H1'117.4°122.3°
C2'C1'N9C878.8°121.5°
C2'C1'N9C4107.5°58.5°
H2'C2'O2'HO2'57.4°61.1°
H2'C2'C1'N97.6°24.2°
H2'C2'C1'H1'111.2°146.4°
C1'N9C8C4174.7°180.0°
C1'N9C8N7174.1°180.0°
C1'N9C8H8148.8°61.0°
C1'N9C8H8260.6°60.9°
C1'N9C4C5174.3°179.7°
C1'N9C4N35.5°0.0°
H1'C1'N9C8163.8°0.7°
H1'C1'N9C49.9°179.3°
N9C8N7H81125.2°119.0°
N9C8N7H82125.3°119.1°
N9C8H81H82116.4°121.9°
N9C8N7CM7177.0°180.0°
N9C8N7C50.3°0.3°
C8N9C4C50.6°0.3°
C8N9C4N3179.6°180.0°
C4N9C8N70.6°0.0°
C4N9C8H81125.8°119.0°
C4N9C8H82124.7°119.0°
N9C4C5N70.4°0.4°
N9C4C5C6179.7°180.0°
N9C4C5N3179.8°179.7°
N9C4N3C2179.6°179.8°
N7C8H81H82116.5°121.9°
C8N7CM7C5176.6°179.6°
C8N7CM7HM71180.0°180.0°
C8N7CM7HM7254.7°60.0°
C8N7CM7HM7354.7°60.0°
C8N7C5C6179.9°179.9°
C8N7C5C40.0°0.4°
H81C8N7CM751.8°61.1°
H81C8N7C5125.6°119.2°
H82C8N7CM757.7°60.9°
H82C8N7C5124.9°118.8°
N7CM7HM71HM72125.2°120.0°
N7CM7HM71HM73125.3°120.0°
N7CM7HM72HM73112.3°120.0°
CM7N7C5C63.0°0.4°
CM7N7C5C4177.1°179.9°
C5N7CM7HM713.4°0.3°
C5N7CM7HM72121.8°119.6°
C5N7CM7HM73128.7°120.4°
N7C5C6C4179.9°179.4°
N7C5C6O60.6°0.6°
N7C5C6N1179.9°179.5°
N7C5C4N3179.8°179.8°
HM71CM7HM72HM73112.4°120.0°
C5C6O6N1179.4°180.0°
C5C6N1C20.2°0.1°
C5C6N1HN1179.7°180.0°
C6C5C4N30.1°0.3°
C4C5C6O6179.5°179.9°
C4C5C6N10.1°0.1°
C5C4N3C20.2°0.5°
O6C6N1C2179.7°180.0°
O6C6N1HN10.2°0.0°
C6N1C2HN1179.9°180.0°
C6N1C2N2179.7°179.9°
C6N1C2N30.2°0.3°
N1C2N2N3179.5°179.8°
N1C2N2HN21179.9°179.9°
N1C2N2HN2254.7°0.1°
N1C2N3C40.0°0.5°
HN1N1C2N20.3°0.0°
HN1N1C2N3179.8°179.8°
C2N2HN21HN22125.4°179.8°
N2C2N3C4179.5°179.7°
N3C2N2HN210.4°0.1°
N3C2N2HN22125.8°179.7°

246704

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