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MNT

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
PBO1Bdoub1.48Å1.47Å
PBO2Bsing1.61Å1.51Å
PBO3Bsing1.61Å1.58Å
PBO3Asing1.61Å1.68Å
O2BHOB2sing0.97Å0.95Å
O3BHOB3sing0.97Å0.95Å
PAO1Adoub1.48Å1.49Å
PAO2Asing1.61Å1.48Å
PAO3Asing1.61Å1.55Å
PAO5'sing1.61Å1.62Å
O2AHOA2sing0.97Å0.95Å
O5'C5Bsing1.43Å1.45Å
C5BC4Bsing1.53Å1.52Å
C5BH5'1sing1.09Å1.11Å
C5BH5'2sing1.09Å1.12Å
C4BO4'sing1.45Å1.41Å
C4BC3Bsing1.54Å1.52Å
C4BH4Bsing1.09Å1.11Å
O4'C1Bsing1.44Å1.43Å
C3BO3'sing1.45Å1.43Å
C3BC2Bsing1.55Å1.32Å
C3BH3Bsing1.09Å1.12Å
O3'C'sing1.35Å1.40Å
C2BC1Bsing1.54Å1.50Å
C2BH2'1sing1.09Å1.12Å
C2BH2'2sing1.09Å1.11Å
C1BN9sing1.47Å1.49Å
C1BH1'sing1.09Å1.11Å
N9C8sing1.36Å1.39ÅAromatic
N9C4sing1.37Å1.34ÅAromatic
C8N7doub1.30Å1.39ÅAromatic
C8H8sing1.08Å1.10Å
N7C5sing1.35Å1.39ÅAromatic
C5C6sing1.41Å1.42ÅAromatic
C5C4doub1.40Å1.42ÅAromatic
C6N6sing1.38Å1.32Å
C6N1doub1.33Å1.37ÅAromatic
N6HN61sing0.97Å1.02Å
N6HN62sing0.97Å1.02Å
N1C2sing1.32Å1.39ÅAromatic
C2N3doub1.32Å1.34ÅAromatic
C2H2sing1.08Å1.10Å
N3C4sing1.33Å1.35ÅAromatic
C'O1'doub1.21Å1.21Å
C'C1'sing1.47Å1.53Å
C1'C2'doub1.40Å1.46ÅAromatic
C1'C6'sing1.40Å1.45ÅAromatic
C2'N2'sing1.39Å1.36Å
C2'C3'sing1.39Å1.44ÅAromatic
N2'CM'sing1.46Å1.44Å
N2'HN2'sing0.97Å1.02Å
CM'HM'1sing1.09Å1.12Å
CM'HM'2sing1.09Å1.12Å
CM'HM'3sing1.09Å1.11Å
C3'C4'doub1.38Å1.41ÅAromatic
C3'H3'sing1.08Å1.10Å
C4'C5'sing1.39Å1.44ÅAromatic
C4'H4'sing1.08Å1.10Å
C5'C6'doub1.38Å1.42ÅAromatic
C5'H5'sing1.08Å1.10Å
C6'H6'sing1.08Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1BPBO2B117.2°109.5°
O1BPBO3B108.4°109.5°
O1BPBO3A113.2°109.5°
O2BPBO3B108.1°109.4°
O2BPBO3A107.2°109.5°
PBO2BHOB2117.3°106.8°
O3BPBO3A101.6°109.5°
PBO3BHOB3108.3°106.8°
PBO3APA129.7°106.8°
O1APAO2A118.0°109.4°
O1APAO3A112.3°109.5°
O1APAO5'103.6°109.4°
O2APAO3A107.2°109.4°
O2APAO5'113.2°109.5°
PAO2AHOA2118.0°106.8°
O3APAO5'101.4°109.5°
PAO5'C5B117.3°106.9°
O5'C5BC4B109.7°109.6°
O5'C5BH5'1112.1°109.5°
O5'C5BH5'2112.1°109.5°
C4BC5BH5'1112.1°109.5°
C4BC5BH5'2112.1°109.5°
C5BC4BO4'106.6°110.3°
C5BC4BC3B119.2°110.7°
C5BC4BH4B103.1°110.3°
H5'1C5BH5'298.3°109.3°
O4'C4BC3B102.9°104.8°
O4'C4BH4B119.3°110.3°
C4BO4'C1B111.6°105.3°
C3BC4BH4B106.8°110.3°
C4BC3BO3'119.2°110.6°
C4BC3BC2B111.0°104.2°
C4BC3BH3B105.4°110.5°
O4'C1BC2B104.4°104.8°
O4'C1BN9103.4°110.5°
O4'C1BH1'117.1°110.4°
O3'C3BC2B119.2°110.5°
O3'C3BH3B92.5°110.4°
C3BO3'C'124.4°120.1°
C2BC3BH3B105.4°110.4°
C3BC2BC1B107.9°104.0°
C3BC2BH2'1112.8°110.5°
C3BC2BH2'2112.8°110.5°
O3'C'O1'113.4°119.9°
O3'C'C1'118.3°120.1°
C1BC2BH2'1112.8°110.6°
C1BC2BH2'2112.8°110.5°
C2BC1BN9111.6°110.3°
C2BC1BH1'109.6°110.4°
H2'1C2BH2'297.6°110.6°
N9C1BH1'110.5°110.3°
C1BN9C8133.5°126.3°
C1BN9C4122.2°126.3°
C8N9C4104.3°107.4°
N9C8N7115.5°110.0°
N9C8H8122.1°125.0°
N9C4C5108.7°106.0°
N9C4N3121.7°134.9°
N7C8H8122.4°125.0°
C8N7C5100.2°109.4°
N7C5C6129.7°134.7°
N7C5C4111.2°107.2°
C6C5C4115.5°118.2°
C5C6N6127.8°120.8°
C5C6N1114.6°118.5°
C5C4N3129.6°119.1°
N6C6N1105.9°120.8°
C6N6HN61127.9°120.0°
C6N6HN62105.8°120.0°
C6N1C2118.6°121.2°
HN61N6HN62105.7°120.0°
N1C2N3131.1°122.4°
N1C2H2116.9°118.7°
N3C2H2112.1°118.8°
C2N3C4106.2°120.7°
O1'C'C1'116.6°120.0°
C'C1'C2'105.6°120.3°
C'C1'C6'127.2°120.2°
C2'C1'C6'119.8°119.5°
C1'C2'N2'127.9°120.1°
C1'C2'C3'116.3°119.7°
C1'C6'C5'120.8°120.0°
C1'C6'H6'120.4°120.0°
N2'C2'C3'114.1°120.2°
C2'N2'CM'121.7°120.0°
C2'N2'HN2'107.8°120.1°
C2'C3'C4'124.1°120.1°
C2'C3'H3'119.1°120.0°
CM'N2'HN2'107.8°120.0°
N2'CM'HM'1121.7°109.5°
N2'CM'HM'2107.9°109.5°
N2'CM'HM'3107.8°109.5°
HM'1CM'HM'2107.8°109.5°
HM'1CM'HM'3107.9°109.4°
HM'2CM'HM'3102.1°109.5°
C4'C3'H3'116.8°119.9°
C3'C4'C5'118.4°120.4°
C3'C4'H4'119.9°119.8°
C5'C4'H4'121.7°119.8°
C4'C5'C6'119.9°120.3°
C4'C5'H5'120.6°119.8°
C6'C5'H5'119.5°119.8°
C5'C6'H6'118.8°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1BPBO2BO3B122.7°120.0°
O1BPBO2BO3A128.5°120.0°
O1BPBO3BO3A119.4°120.0°
O1BPBO2BHOB2180.0°59.9°
O1BPBO3BHOB3180.0°180.0°
O1BPBO3APA118.9°60.0°
O2BPBO3BO3A112.6°120.0°
O2BPBO3BHOB352.0°60.0°
O2BPBO3APA11.9°180.0°
O3BPBO2BHOB257.3°60.0°
O3BPBO3APA125.1°60.0°
O3APBO2BHOB251.5°180.0°
O3APBO3BHOB360.6°60.0°
PBO3APAO1A54.9°60.0°
PBO3APAO2A76.2°60.0°
PBO3APAO5'164.9°180.0°
O1APAO2AO3A127.9°120.0°
O1APAO2AO5'121.2°120.0°
O1APAO3AO5'110.0°120.0°
O1APAO2AHOA2180.0°180.0°
O1APAO5'C5B177.9°60.0°
O2APAO3AO5'118.9°120.0°
O2APAO5'C5B48.9°60.0°
O3APAO2AHOA252.1°60.0°
O3APAO5'C5B65.6°180.0°
O5'PAO2AHOA258.8°60.0°
PAO5'C5BC4B136.2°180.0°
PAO5'C5BH5'110.9°59.9°
PAO5'C5BH5'298.5°59.9°
O5'C5BC4BH5'1125.2°120.1°
O5'C5BC4BH5'2125.2°120.1°
O5'C5BH5'1H5'2118.0°119.9°
O5'C5BC4BO4'65.2°61.4°
O5'C5BC4BC3B50.4°176.9°
O5'C5BC4BH4B168.4°60.7°
C4BC5BH5'1H5'2118.1°119.9°
C5BC4BO4'C3B126.2°119.2°
C5BC4BO4'H4B115.9°122.1°
C5BC4BC3BH4B116.0°122.3°
C5BC4BO4'C1B132.2°159.5°
C5BC4BC3BO3'101.9°98.5°
C5BC4BC3BC2B113.7°142.7°
C5BC4BC3BH3B0.0°24.1°
H5'1C5BC4BO4'169.5°178.5°
H5'1C5BC4BC3B74.8°63.0°
H5'1C5BC4BH4B43.1°59.3°
H5'2C5BC4BO4'60.0°58.7°
H5'2C5BC4BC3B175.7°56.8°
H5'2C5BC4BH4B66.4°179.2°
O4'C4BC3BH4B126.4°118.7°
O4'C4BC3BO3'140.5°142.5°
O4'C4BC3BC2B3.9°23.8°
O4'C4BC3BH3B117.5°94.9°
C4BO4'C1BC2B12.5°40.4°
C4BO4'C1BN9129.3°159.3°
C4BO4'C1BH1'108.9°78.4°
C3BC4BO4'C1B6.0°40.3°
C4BC3BO3'C2B141.5°114.9°
C4BC3BO3'H3B109.2°122.7°
C4BC3BC2BH3B113.7°118.7°
C4BC3BO3'C'147.8°151.9°
C4BC3BC2BC1B11.5°0.1°
C4BC3BC2BH2'1113.8°118.6°
C4BC3BC2BH2'2136.8°118.7°
H4BC4BO4'C1B111.9°78.4°
H4BC4BC3BO3'14.1°23.8°
H4BC4BC3BC2B130.2°94.9°
H4BC4BC3BH3B116.1°146.4°
O4'C1BC2BC3B14.6°24.0°
O4'C1BC2BN9111.0°118.9°
O4'C1BC2BH1'126.2°118.9°
O4'C1BC2BH2'1110.6°94.6°
O4'C1BC2BH2'2139.9°142.6°
O4'C1BN9H1'126.1°122.3°
O4'C1BN9C832.5°25.4°
O4'C1BN9C4145.7°154.9°
O3'C3BC2BH3B101.9°122.5°
O3'C3BC2BC1B132.9°118.7°
O3'C3BC2BH2'1101.9°122.6°
O3'C3BC2BH2'27.6°0.1°
C3BO3'C'O1'14.4°0.0°
C3BO3'C'C1'156.2°179.9°
C2BC3BO3'C'70.7°93.3°
C3BC2BC1BH2'1125.3°118.6°
C3BC2BC1BH2'2125.3°118.6°
C3BC2BH2'1H2'2118.8°122.7°
C3BC2BC1BN9125.7°142.9°
C3BC2BC1BH1'111.6°94.9°
H3BC3BO3'C'38.6°29.2°
H3BC3BC2BC1B125.2°118.8°
H3BC3BC2BH2'10.1°0.2°
H3BC3BC2BH2'2109.6°122.6°
O3'C'O1'C1'142.6°180.0°
O3'C'C1'C2'176.6°174.8°
O3'C'C1'C6'34.1°5.8°
C1BC2BH2'1H2'2118.7°122.7°
C2BC1BN9H1'122.3°122.2°
C2BC1BN9C879.2°90.0°
C2BC1BN9C4102.6°89.7°
H2'1C2BC1BN90.4°24.3°
H2'1C2BC1BH1'123.2°146.5°
H2'2C2BC1BN9109.0°98.4°
H2'2C2BC1BH1'13.7°23.7°
C1BN9C8C4178.4°179.7°
C1BN9C8N7179.1°180.0°
C1BN9C8H80.9°0.0°
C1BN9C4C5178.7°179.9°
C1BN9C4N31.0°0.9°
H1'C1BN9C8158.5°147.8°
H1'C1BN9C419.6°32.5°
N9C8N7H8180.0°180.0°
N9C8N7C51.1°0.0°
C8N9C4C52.7°0.4°
C8N9C4N3179.6°179.4°
C4N9C8N72.5°0.3°
C4N9C8H8177.5°179.7°
N9C4C5N72.2°0.4°
N9C4C5C6158.8°179.8°
N9C4C5N3177.4°179.2°
N9C4N3C2175.5°179.5°
C8N7C5C6156.9°180.0°
C8N7C5C40.7°0.3°
H8C8N7C5178.9°180.0°
N7C5C6C4156.7°179.7°
N7C5C6N642.9°0.0°
N7C5C6N1179.7°180.0°
N7C5C4N3179.7°179.6°
C5C6N6N1140.3°180.0°
C5C6N6HN61180.0°180.0°
C5C6N6HN6254.7°0.0°
C5C6N1C213.4°0.0°
C6C5C4N318.7°0.6°
C4C5C6N6160.4°179.7°
C4C5C6N122.9°0.3°
C5C4N3C21.7°0.7°
C6N6HN61HN62125.3°180.0°
N6C6N1C2159.7°180.0°
N1C6N6HN6139.7°0.0°
N1C6N6HN62165.0°180.0°
C6N1C2N35.2°0.0°
C6N1C2H2174.8°180.0°
N1C2N3H2180.0°180.0°
N1C2N3C411.1°0.3°
H2C2N3C4168.9°179.7°
O1'C'C1'C2'35.9°5.2°
O1'C'C1'C6'174.8°174.2°
C'C1'C2'C6'152.0°179.4°
C'C1'C2'N2'49.6°0.3°
C'C1'C2'C3'146.2°180.0°
C'C1'C6'C5'137.5°180.0°
C'C1'C6'H6'42.4°0.2°
C1'C2'N2'C3'164.5°179.7°
C1'C2'N2'CM'173.0°174.0°
C1'C2'N2'HN2'61.7°6.0°
C1'C2'C3'C4'1.0°0.3°
C1'C2'C3'H3'179.0°179.7°
C2'C1'C6'C5'7.9°0.6°
C2'C1'C6'H6'172.1°179.6°
C6'C1'C2'N2'158.4°179.7°
C6'C1'C2'C3'5.8°0.6°
C1'C6'C5'C4'3.0°0.3°
C1'C6'C5'H6'180.0°179.8°
C1'C6'C5'H5'177.0°179.8°
C2'N2'CM'HN2'125.3°180.0°
C2'N2'CM'HM'1180.0°180.0°
C2'N2'CM'HM'254.8°60.0°
C2'N2'CM'HM'354.8°60.1°
N2'C2'C3'C4'167.4°180.0°
N2'C2'C3'H3'12.6°0.0°
C3'C2'N2'CM'8.5°5.7°
C3'C2'N2'HN2'133.8°174.3°
C2'C3'C4'H3'180.0°180.0°
C2'C3'C4'C5'5.9°0.0°
C2'C3'C4'H4'174.1°179.9°
N2'CM'HM'1HM'2125.2°120.1°
N2'CM'HM'1HM'3125.3°120.0°
N2'CM'HM'2HM'3113.4°120.0°
HN2'N2'CM'HM'154.7°0.1°
HN2'N2'CM'HM'270.5°120.0°
HN2'N2'CM'HM'3180.0°120.0°
HM'1CM'HM'2HM'3113.5°119.9°
C3'C4'C5'H4'180.0°180.0°
C3'C4'C5'C6'3.7°0.0°
C3'C4'C5'H5'176.3°180.0°
H3'C3'C4'C5'174.1°180.0°
H3'C3'C4'H4'5.9°0.0°
C4'C5'C6'H5'180.0°180.0°
C4'C5'C6'H6'177.0°179.9°
H4'C4'C5'C6'176.2°180.0°
H4'C4'C5'H5'3.8°0.0°
H5'C5'C6'H6'3.0°0.0°

224931

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