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BIS

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
PBO2Bsing1.61Å1.61Å
PBO3Bdoub1.48Å1.49Å
PBO3Asing1.61Å1.54Å
PBC11sing1.82Å1.82Å
O2BHO2Bsing0.97Å0.95Å
PAO1Asing1.61Å1.48Å
PAO2Adoub1.48Å1.47Å
PAO3Asing1.61Å1.57Å
PAO5'sing1.61Å1.59Å
O1AHO1Asing0.97Å0.95Å
O5'C5'sing1.43Å1.44Å
C5'C4'sing1.53Å1.50Å
C5'H5'1sing1.09Å1.11Å
C5'H5'2sing1.09Å1.12Å
C4'O4'sing1.44Å1.44Å
C4'C3'sing1.54Å1.52Å
C4'H4'sing1.09Å1.11Å
O4'C1'sing1.44Å1.43Å
C3'O3'sing1.43Å1.42Å
C3'C2'sing1.55Å1.52Å
C3'H3'sing1.09Å1.12Å
O3'HO'3sing0.97Å0.95Å
C2'O2'sing1.43Å1.45Å
C2'C1'sing1.54Å1.52Å
C2'H2'sing1.09Å1.11Å
O2'HO'2sing0.97Å0.95Å
C1'N9sing1.46Å1.50Å
C1'H1'sing1.09Å1.11Å
N9C8sing1.36Å1.34ÅAromatic
N9C4sing1.37Å1.32ÅAromatic
C8N7doub1.30Å1.33ÅAromatic
C8H8sing1.08Å1.10Å
N7C5sing1.35Å1.31ÅAromatic
C5C6sing1.40Å1.39ÅAromatic
C5C4doub1.41Å1.41ÅAromatic
C6N6sing1.38Å1.36Å
C6N1doub1.33Å1.37ÅAromatic
N6HN61sing0.97Å1.02Å
N6HN62sing0.97Å1.02Å
N1C2sing1.32Å1.34ÅAromatic
C2N3doub1.32Å1.34ÅAromatic
C2H2sing1.08Å1.10Å
N3C4sing1.33Å1.34ÅAromatic
C11F11sing1.40Å1.35Å
C11F12sing1.40Å1.33Å
C11C12sing1.53Å1.53Å
C12C13sing1.53Å1.54Å
C12H121sing1.09Å1.12Å
C12H122sing1.09Å1.11Å
C13C14sing1.53Å1.53Å
C13H131sing1.09Å1.11Å
C13H132sing1.09Å1.12Å
C14C15sing1.53Å1.55Å
C14H141sing1.09Å1.11Å
C14H142sing1.09Å1.11Å
C15F51sing1.40Å1.32Å
C15F52sing1.40Å1.32Å
C15PNsing1.82Å1.82Å
PNON1sing1.61Å1.53Å
PNON2sing1.61Å1.54Å
PNON3doub1.48Å1.53Å
ON1HO1sing0.97Å0.95Å
ON2HO2sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O2BPBO3B116.3°109.5°
O2BPBO3A101.0°109.5°
O2BPBC11108.3°109.5°
PBO2BHO2B116.3°106.8°
O3BPBO3A108.6°109.5°
O3BPBC11111.1°109.5°
O3APBC11111.2°109.5°
PBO3APA140.2°106.8°
PBC11F11107.9°109.4°
PBC11F12106.8°109.5°
PBC11C12109.3°109.5°
O1APAO2A112.4°109.4°
O1APAO3A107.5°109.5°
O1APAO5'110.4°109.5°
PAO1AHO1A112.4°106.8°
O2APAO3A116.0°109.5°
O2APAO5'110.9°109.5°
O3APAO5'98.8°109.5°
PAO5'C5'119.1°106.8°
O5'C5'C4'104.6°109.4°
O5'C5'H5'1114.0°109.5°
O5'C5'H5'2114.0°109.5°
C4'C5'H5'1114.0°109.5°
C4'C5'H5'2114.0°109.5°
C5'C4'O4'110.9°110.3°
C5'C4'C3'113.6°110.5°
C5'C4'H4'105.7°110.3°
H5'1C5'H5'296.5°109.5°
O4'C4'C3'109.9°104.8°
O4'C4'H4'109.7°110.4°
C4'O4'C1'105.1°105.3°
C3'C4'H4'106.8°110.4°
C4'C3'O3'114.3°110.5°
C4'C3'C2'103.6°104.1°
C4'C3'H3'112.1°110.5°
O4'C1'C2'107.6°105.0°
O4'C1'N9114.7°110.4°
O4'C1'H1'107.7°110.3°
O3'C3'C2'114.3°110.6°
O3'C3'H3'100.8°110.5°
C3'O3'HO'3114.2°106.8°
C2'C3'H3'112.0°110.6°
C3'C2'O2'114.5°110.5°
C3'C2'C1'101.6°104.0°
C3'C2'H2'113.6°110.5°
O2'C2'C1'115.3°110.8°
O2'C2'H2'99.5°110.5°
C2'O2'HO'2114.6°106.8°
C1'C2'H2'112.9°110.5°
C2'C1'N9110.8°110.3°
C2'C1'H1'111.8°110.3°
N9C1'H1'104.3°110.3°
C1'N9C8126.9°126.3°
C1'N9C4124.0°126.3°
C8N9C4108.9°107.4°
N9C8N7108.2°110.0°
N9C8H8125.9°125.0°
N9C4C5106.8°106.0°
N9C4N3133.3°134.9°
N7C8H8125.9°125.0°
C8N7C5109.7°109.5°
N7C5C6134.9°134.7°
N7C5C4106.3°107.1°
C6C5C4118.8°118.2°
C5C6N6120.3°120.8°
C5C6N1117.7°118.4°
C5C4N3119.8°119.1°
N6C6N1122.0°120.8°
C6N6HN61120.3°120.0°
C6N6HN62108.3°119.9°
C6N1C2122.7°121.2°
HN61N6HN62108.4°120.1°
N1C2N3119.8°122.5°
N1C2H2120.1°118.7°
N3C2H2120.1°118.8°
C2N3C4121.2°120.7°
F11C11F12112.1°109.5°
F11C11C12111.6°109.5°
F12C11C12109.1°109.5°
C11C12C13110.6°109.4°
C11C12H121111.8°109.5°
C11C12H122111.8°109.5°
C13C12H121111.8°109.5°
C13C12H122111.8°109.4°
C12C13C14109.1°109.5°
C12C13H131112.4°109.6°
C12C13H132112.3°109.5°
H121C12H12298.6°109.5°
C14C13H131112.3°109.4°
C14C13H132112.3°109.4°
C13C14C15113.5°109.5°
C13C14H141110.7°109.4°
C13C14H142110.7°109.5°
H131C13H13298.1°109.4°
C15C14H141110.7°109.5°
C15C14H142110.7°109.4°
C14C15F51115.5°109.5°
C14C15F52108.4°109.5°
C14C15PN111.4°109.5°
H141C14H14299.6°109.5°
F51C15F52106.1°109.5°
F51C15PN107.5°109.5°
F52C15PN107.6°109.4°
C15PNON1109.7°109.5°
C15PNON2108.9°109.4°
C15PNON3108.0°109.5°
ON1PNON2108.1°109.5°
ON1PNON3115.3°109.5°
PNON1HO1109.7°106.8°
ON2PNON3106.7°109.5°
PNON2HO2108.9°106.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O2BPBO3BO3A113.0°120.0°
O2BPBO3BC11124.4°120.0°
O2BPBO3AC11114.7°120.0°
O2BPBO3APA169.0°60.0°
O2BPBC11F11168.7°59.9°
O2BPBC11F1270.7°180.0°
O2BPBC11C1247.2°60.0°
O3BPBO3AC11122.5°120.0°
O3BPBO2BHO2B180.0°180.0°
O3BPBO3APA46.2°60.0°
O3BPBC11F1162.4°60.1°
O3BPBC11F1258.2°60.0°
O3BPBC11C12176.1°180.0°
O3APBO2BHO2B62.8°60.1°
PBO3APAO1A98.9°60.0°
PBO3APAO2A27.8°60.0°
PBO3APAO5'146.4°180.0°
O3APBC11F1158.6°180.0°
O3APBC11F12179.3°60.0°
O3APBC11C1262.9°60.0°
C11PBO2BHO2B54.1°60.0°
C11PBO3APA76.3°180.0°
PBC11F11F12117.2°120.0°
PBC11F11C12120.1°119.9°
PBC11F12C12118.0°120.0°
PBC11C12C13177.9°180.0°
PBC11C12H12152.7°60.0°
PBC11C12H12256.8°60.0°
O1APAO2AO3A124.2°120.0°
O1APAO2AO5'124.1°120.0°
O1APAO3AO5'114.7°120.0°
O1APAO5'C5'62.0°60.0°
O2APAO3AO5'118.6°120.0°
O2APAO1AHO1A179.9°180.0°
O2APAO5'C5'172.9°60.0°
O3APAO1AHO1A51.1°60.0°
O3APAO5'C5'50.5°180.0°
O5'PAO1AHO1A55.7°60.0°
PAO5'C5'C4'131.6°180.0°
PAO5'C5'H5'1103.1°60.0°
PAO5'C5'H5'26.4°60.0°
O5'C5'C4'H5'1125.3°120.0°
O5'C5'C4'H5'2125.2°120.0°
O5'C5'H5'1H5'2119.9°120.1°
O5'C5'C4'O4'55.1°61.5°
O5'C5'C4'C3'179.5°176.9°
O5'C5'C4'H4'63.8°60.8°
C4'C5'H5'1H5'2120.0°120.0°
C5'C4'O4'C3'126.5°118.9°
C5'C4'O4'H4'116.4°122.2°
C5'C4'C3'H4'116.1°122.3°
C5'C4'O4'C1'141.3°159.4°
C5'C4'C3'O3'117.2°98.3°
C5'C4'C3'C2'117.7°142.9°
C5'C4'C3'H3'3.3°24.2°
H5'1C5'C4'O4'70.2°178.6°
H5'1C5'C4'C3'54.2°63.1°
H5'1C5'C4'H4'170.9°59.2°
H5'2C5'C4'O4'179.7°58.6°
H5'2C5'C4'C3'55.3°56.9°
H5'2C5'C4'H4'61.4°179.2°
O4'C4'C3'H4'119.0°118.9°
O4'C4'C3'O3'117.8°142.8°
O4'C4'C3'C2'7.3°24.1°
O4'C4'C3'H3'128.3°94.6°
C4'O4'C1'C2'31.6°40.4°
C4'O4'C1'N9155.3°159.4°
C4'O4'C1'H1'89.1°78.4°
C3'C4'O4'C1'14.8°40.5°
C4'C3'O3'C2'119.2°114.7°
C4'C3'O3'H3'120.4°122.6°
C4'C3'C2'H3'121.1°118.7°
C4'C3'O3'HO'3179.9°180.0°
C4'C3'C2'O2'149.7°118.8°
C4'C3'C2'C1'24.6°0.1°
C4'C3'C2'H2'96.9°118.7°
H4'C4'O4'C1'102.3°78.4°
H4'C4'C3'O3'1.2°24.0°
H4'C4'C3'C2'126.2°94.8°
H4'C4'C3'H3'112.8°146.5°
O4'C1'C2'C3'35.6°23.8°
O4'C1'C2'O2'160.1°142.5°
O4'C1'C2'N9126.1°118.9°
O4'C1'C2'H1'118.0°118.9°
O4'C1'C2'H2'86.5°94.7°
O4'C1'N9H1'117.5°122.2°
O4'C1'N9C863.0°27.1°
O4'C1'N9C4121.7°152.9°
O3'C3'C2'H3'113.9°122.7°
O3'C3'C2'O2'24.7°0.1°
O3'C3'C2'C1'100.4°118.8°
O3'C3'C2'H2'138.1°122.7°
C2'C3'O3'HO'360.9°65.3°
C3'C2'O2'C1'117.5°114.7°
C3'C2'O2'H2'121.5°122.6°
C3'C2'C1'H2'122.1°118.5°
C3'C2'O2'HO'2180.0°61.5°
C3'C2'C1'N9161.7°142.8°
C3'C2'C1'H1'82.4°95.0°
H3'C3'O3'HO'359.5°57.4°
H3'C3'C2'O2'89.3°122.6°
H3'C3'C2'C1'145.7°118.5°
H3'C3'C2'H2'24.2°0.0°
O2'C2'C1'H2'113.4°122.8°
O2'C2'C1'N973.8°98.5°
O2'C2'C1'H1'42.1°23.7°
C1'C2'O2'HO'262.5°176.1°
C2'C1'N9H1'120.5°122.2°
C2'C1'N9C859.0°88.5°
C2'C1'N9C4116.3°91.5°
H2'C2'O2'HO'258.4°61.1°
H2'C2'C1'N939.6°24.2°
H2'C2'C1'H1'155.5°146.4°
C1'N9C8C4175.8°180.0°
C1'N9C8N7175.4°180.0°
C1'N9C8H84.6°0.0°
C1'N9C4C5174.6°179.8°
C1'N9C4N33.5°0.1°
H1'C1'N9C8179.4°149.3°
H1'C1'N9C44.2°30.7°
N9C8N7H8180.0°180.0°
N9C8N7C50.9°0.3°
C8N9C4C51.4°0.2°
C8N9C4N3179.5°179.9°
C4N9C8N70.4°0.0°
C4N9C8H8179.6°180.0°
N9C4C5N71.9°0.4°
N9C4C5C6177.6°179.6°
N9C4C5N3178.4°179.9°
N9C4N3C2177.7°180.0°
C8N7C5C6177.7°179.5°
C8N7C5C41.7°0.4°
H8C8N7C5179.1°179.7°
N7C5C6C4179.3°179.0°
N7C5C6N60.6°0.7°
N7C5C6N1180.0°179.5°
N7C5C4N3179.7°179.7°
C5C6N6N1179.4°179.7°
C5C6N6HN61180.0°179.7°
C5C6N6HN6254.7°0.5°
C5C6N1C20.1°0.3°
C6C5C4N30.8°0.5°
C4C5C6N6178.7°179.7°
C4C5C6N10.7°0.6°
C5C4N3C20.2°0.2°
C6N6HN61HN62125.2°179.9°
N6C6N1C2179.5°180.0°
N1C6N6HN610.6°0.0°
N1C6N6HN62124.7°179.8°
C6N1C2N30.8°0.0°
C6N1C2H2179.3°179.9°
N1C2N3H2180.0°179.9°
N1C2N3C40.6°0.1°
H2C2N3C4179.4°180.0°
F11C11F12C12124.1°120.1°
F11C11C12C1358.7°60.0°
F11C11C12H12166.5°179.9°
F11C11C12H122176.0°59.9°
F12C11C12C1365.7°60.1°
F12C11C12H121169.1°60.0°
F12C11C12H12259.6°180.0°
C11C12C13H121125.3°120.0°
C11C12C13H122125.3°119.9°
C11C12H121H122117.7°120.0°
C11C12C13C14138.9°180.0°
C11C12C13H13113.7°60.0°
C11C12C13H13295.8°60.0°
C13C12H121H122117.7°120.0°
C12C13C14H131125.3°120.1°
C12C13C14H132125.3°120.0°
C12C13H131H132118.3°120.1°
C12C13C14C15162.4°180.0°
C12C13C14H14137.2°60.0°
C12C13C14H14272.4°60.0°
H121C12C13C1495.8°60.0°
H121C12C13H131138.9°180.0°
H121C12C13H13229.4°60.0°
H122C12C13C1413.6°60.1°
H122C12C13H131111.6°59.9°
H122C12C13H132138.9°180.0°
C14C13H131H132118.2°119.9°
C13C14C15H141125.2°120.0°
C13C14C15H142125.2°120.0°
C13C14H141H142116.6°120.0°
C13C14C15F5123.9°60.0°
C13C14C15F52142.7°60.0°
C13C14C15PN99.1°180.0°
H131C13C14C1572.3°59.9°
H131C13C14H141162.5°179.9°
H131C13C14H14252.9°60.1°
H132C13C14C1537.1°59.9°
H132C13C14H14188.1°60.0°
H132C13C14H142162.3°179.9°
C15C14H141H142116.6°120.0°
C14C15F51F52120.1°120.0°
C14C15F51PN125.1°120.0°
C14C15F52PN120.6°120.0°
C14C15PNON176.8°60.0°
C14C15PNON2165.2°60.0°
C14C15PNON349.6°180.0°
H141C14C15F51101.3°180.0°
H141C14C15F5217.5°60.0°
H141C14C15PN135.7°60.0°
H142C14C15F51149.1°60.0°
H142C14C15F5292.0°180.0°
H142C14C15PN26.1°60.0°
F51C15F52PN114.8°119.9°
F51C15PNON150.7°180.0°
F51C15PNON267.4°60.0°
F51C15PNON3177.1°60.0°
F52C15PNON1164.5°60.0°
F52C15PNON246.5°180.0°
F52C15PNON369.0°60.0°
C15PNON1ON2118.6°120.0°
C15PNON1ON3122.1°120.0°
C15PNON2ON3116.3°120.0°
C15PNON1HO1179.9°179.9°
C15PNON2HO2180.0°60.0°
ON1PNON2ON3124.6°120.0°
ON1PNON2HO260.9°60.0°
ON2PNON1HO161.4°60.0°
ON3PNON1HO157.9°60.0°
ON3PNON2HO263.7°180.0°

222415

PDB entries from 2024-07-10

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