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IN3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.38Å1.40ÅAromatic
C1C6sing1.38Å1.40ÅAromatic
C1H1sing1.08Å1.10Å
C2C3sing1.38Å1.39ÅAromatic
C2H2sing1.08Å1.10Å
C3C4doub1.38Å1.40ÅAromatic
C3H3sing1.08Å1.10Å
C4C5sing1.38Å1.40ÅAromatic
C4C7sing1.51Å1.51Å
C5C6doub1.38Å1.40ÅAromatic
C5H5sing1.08Å1.10Å
C6H6sing1.08Å1.10Å
C7O8sing1.43Å1.43Å
C7H71sing1.09Å1.12Å
C7H72sing1.09Å1.11Å
O8C9sing1.36Å1.43Å
C9C10doub1.39Å1.39ÅAromatic
C9C24sing1.38Å1.39ÅAromatic
C10C14sing1.38Å1.41ÅAromatic
C10H10sing1.08Å1.10Å
C11C12sing1.40Å1.39ÅAromatic
C11C17sing1.48Å1.47Å
C11C24doub1.39Å1.39ÅAromatic
C12C14doub1.38Å1.40ÅAromatic
C12H12sing1.08Å1.10Å
C14H14sing1.08Å1.10Å
C17O18doub1.21Å1.24Å
C17N19sing1.35Å1.39Å
N19N20sing1.40Å1.45Å
N19HN9sing0.97Å1.02Å
N20C21sing1.35Å1.51Å
N20HN0sing0.97Å1.02Å
C24H24sing1.08Å1.10Å
C21O22doub1.22Å1.25Å
C21NK'sing1.35Å1.51Å
C1'C2'doub1.38Å1.39ÅAromatic
C1'C6'sing1.38Å1.41ÅAromatic
C1'H1'sing1.08Å1.10Å
C2'C3'sing1.38Å1.40ÅAromatic
C2'H2'sing1.08Å1.10Å
C3'C4'doub1.38Å1.40ÅAromatic
C3'H3'sing1.08Å1.10Å
C4'C5'sing1.38Å1.40ÅAromatic
C4'C7'sing1.51Å1.51Å
C5'C6'doub1.38Å1.40ÅAromatic
C5'H5'sing1.08Å1.10Å
C6'H6'sing1.08Å1.10Å
C7'O8'sing1.45Å1.43Å
C7'H7'1sing1.09Å1.11Å
C7'H7'2sing1.09Å1.11Å
O8'C9'sing1.35Å1.41Å
C9'OA'doub1.21Å1.24Å
C9'NO'sing1.35Å1.34Å
CB'CC'sing1.53Å1.53Å
CB'CH'sing1.51Å1.53Å
CB'NO'sing1.47Å1.48Å
CB'H11'sing1.09Å1.12Å
CC'CE'sing1.53Å1.53Å
CC'H12Asing1.09Å1.11Å
CC'H12Bsing1.09Å1.12Å
CE'CF'sing1.53Å1.52Å
CE'CG'sing1.53Å1.51Å
CE'H14'sing1.09Å1.12Å
CF'H15Asing1.09Å1.12Å
CF'H15Bsing1.09Å1.12Å
CF'H15Csing1.09Å1.11Å
CG'H16Asing1.09Å1.12Å
CG'H16Bsing1.09Å1.12Å
CG'H16Csing1.09Å1.11Å
CH'OI'doub1.21Å1.23Å
CH'NJ'sing1.35Å1.33Å
NJ'NK'sing1.40Å1.46Å
NJ'HN1sing0.97Å1.02Å
NK'HN2sing0.97Å1.02Å
NO'HN4sing0.97Å1.02Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6119.9°120.0°
C2C1H1120.2°120.0°
C1C2C3120.0°120.0°
C1C2H2120.2°120.0°
C6C1H1120.0°120.0°
C1C6C5119.5°119.9°
C1C6H6120.2°120.0°
C3C2H2119.8°120.0°
C2C3C4120.8°120.0°
C2C3H3119.4°120.0°
C4C3H3119.8°120.0°
C3C4C5118.7°120.0°
C3C4C7120.8°120.0°
C5C4C7120.6°120.0°
C4C5C6121.1°120.1°
C4C5H5119.5°120.0°
C4C7O8121.2°109.5°
C4C7H71108.0°109.4°
C4C7H72108.0°109.5°
C6C5H5119.4°120.0°
C5C6H6120.3°120.0°
O8C7H71108.0°109.4°
O8C7H72108.1°109.6°
C7O8C9123.4°106.8°
H71C7H72101.9°109.4°
O8C9C10127.5°120.0°
O8C9C24114.3°120.0°
C10C9C24118.3°120.0°
C9C10C14120.6°120.3°
C9C10H10119.2°119.8°
C9C24C11122.3°119.8°
C9C24H24118.5°120.1°
C14C10H10120.2°119.9°
C10C14C12119.8°120.2°
C10C14H14120.4°119.9°
C12C11C17130.3°120.1°
C12C11C24119.0°119.8°
C11C12C14120.0°119.9°
C11C12H12119.8°120.0°
C17C11C24110.6°120.1°
C11C17O18126.7°120.0°
C11C17N19102.4°120.0°
C11C24H24119.1°120.1°
C14C12H12120.2°120.0°
C12C14H14119.7°119.9°
O18C17N19130.9°120.0°
C17N19N20127.5°119.9°
C17N19HN9113.7°120.0°
N20N19HN9118.8°120.0°
N19N20C21109.7°120.0°
N19N20HN0112.1°120.0°
C21N20HN0112.1°120.0°
N20C21O22111.2°120.0°
N20C21NK'108.0°119.9°
O22C21NK'111.4°120.1°
C21NK'NJ'107.8°120.0°
C21NK'HN2127.4°120.0°
C2'C1'C6'119.7°120.0°
C2'C1'H1'119.7°120.0°
C1'C2'C3'119.8°120.0°
C1'C2'H2'119.9°120.0°
C6'C1'H1'120.5°120.0°
C1'C6'C5'119.8°120.0°
C1'C6'H6'120.4°120.0°
C3'C2'H2'120.4°120.0°
C2'C3'C4'121.0°120.0°
C2'C3'H3'119.6°120.0°
C4'C3'H3'119.4°120.0°
C3'C4'C5'118.7°120.0°
C3'C4'C7'120.6°120.0°
C5'C4'C7'120.7°120.0°
C4'C5'C6'120.9°120.0°
C4'C5'H5'119.6°120.1°
C4'C7'O8'120.9°109.5°
C4'C7'H7'1108.1°109.5°
C4'C7'H7'2108.1°109.5°
C6'C5'H5'119.5°120.0°
C5'C6'H6'119.8°120.0°
O8'C7'H7'1108.1°109.5°
O8'C7'H7'2108.1°109.4°
C7'O8'C9'119.4°120.1°
H7'1C7'H7'2101.9°109.4°
O8'C9'OA'120.3°119.9°
O8'C9'NO'115.6°120.0°
OA'C9'NO'124.0°120.0°
C9'NO'CB'124.9°120.0°
C9'NO'HN4112.4°120.1°
CC'CB'CH'108.5°109.4°
CC'CB'NO'111.8°109.5°
CC'CB'H11'112.5°109.5°
CB'CC'CE'119.2°109.5°
CB'CC'H12A108.7°109.5°
CB'CC'H12B108.7°109.5°
CH'CB'NO'118.7°109.5°
CH'CB'H11'104.4°109.5°
CB'CH'OI'121.6°120.0°
CB'CH'NJ'113.3°120.0°
NO'CB'H11'100.5°109.5°
CB'NO'HN4122.7°120.0°
CE'CC'H12A108.7°109.4°
CE'CC'H12B108.7°109.5°
CC'CE'CF'111.1°109.5°
CC'CE'CG'109.0°109.5°
CC'CE'H14'109.3°109.5°
H12ACC'H12B101.4°109.4°
CF'CE'CG'111.0°109.5°
CF'CE'H14'107.1°109.5°
CE'CF'H15A111.1°109.4°
CE'CF'H15B111.6°109.5°
CE'CF'H15C111.6°109.4°
CG'CE'H14'109.4°109.4°
CE'CG'H16A108.9°109.5°
CE'CG'H16B112.4°109.4°
CE'CG'H16C112.4°109.5°
H15ACF'H15B111.6°109.5°
H15ACF'H15C111.6°109.4°
H15BCF'H15C98.7°109.5°
H16ACG'H16B112.4°109.5°
H16ACG'H16C112.4°109.5°
H16BCG'H16C98.1°109.5°
OI'CH'NJ'125.1°120.0°
CH'NJ'NK'127.0°120.0°
CH'NJ'HN1111.3°120.0°
NK'NJ'HN1121.7°120.0°
NJ'NK'HN2124.7°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6H1180.0°179.9°
C1C2C3H2180.0°179.9°
C1C2C3C40.2°0.1°
C1C2C3H3179.8°180.0°
C2C1C6C50.0°0.2°
C2C1C6H6180.0°179.9°
C6C1C2C30.2°0.1°
C6C1C2H2179.9°180.0°
C1C6C5C40.1°0.4°
C1C6C5H6180.0°179.8°
C1C6C5H5179.9°180.0°
H1C1C2C3179.8°180.0°
H1C1C2H20.1°0.1°
H1C1C6C5180.0°179.9°
H1C1C6H60.0°0.0°
C2C3C4H3180.0°179.9°
C2C3C4C50.1°0.3°
C2C3C4C7179.1°179.9°
H2C2C3C4179.8°180.0°
H2C2C3H30.2°0.1°
C3C4C5C7179.2°179.7°
C3C4C5C60.1°0.5°
C3C4C5H5179.9°180.0°
C3C4C7O876.9°89.9°
C3C4C7H71157.9°30.0°
C3C4C7H7248.5°149.9°
H3C3C4C5179.9°179.8°
H3C3C4C70.9°0.0°
C4C5C6H5180.0°179.5°
C4C5C6H6179.9°179.7°
C5C4C7O8104.0°90.3°
C5C4C7H7121.3°149.7°
C5C4C7H72130.7°29.8°
C7C4C5C6179.3°179.8°
C7C4C5H50.7°0.3°
C4C7O8H71125.2°119.9°
C4C7O8H72125.3°120.1°
C4C7H71H72113.6°120.0°
C4C7O8C9113.8°180.0°
H5C5C6H60.1°0.2°
O8C7H71H72113.7°120.1°
C7O8C9C1024.0°0.0°
C7O8C9C24156.0°179.6°
H71C7O8C911.4°60.1°
H72C7O8C9120.9°59.9°
O8C9C10C24180.0°179.7°
O8C9C10C14179.9°180.0°
O8C9C10H100.0°0.0°
O8C9C24C11179.7°179.7°
O8C9C24H240.3°0.3°
C9C10C14H10180.0°179.9°
C10C9C24C110.3°0.6°
C9C10C14C120.0°0.0°
C9C10C14H14179.9°179.9°
C10C9C24H24179.7°180.0°
C24C9C10C140.0°0.3°
C24C9C10H10180.0°179.7°
C9C24C11C120.6°0.6°
C9C24C11C17176.0°179.7°
C9C24C11H24180.0°179.4°
C10C14C12C110.3°0.0°
C10C14C12H14180.0°180.0°
C10C14C12H12179.6°180.0°
H10C10C14C12180.0°179.9°
H10C10C14H140.1°0.0°
C12C11C17C24176.1°179.7°
C11C12C14H12179.9°180.0°
C11C12C14H14179.8°180.0°
C12C11C17O1871.7°175.6°
C12C11C17N19108.9°4.5°
C12C11C24H24179.3°180.0°
C17C11C12C14175.2°180.0°
C17C11C12H124.8°0.1°
C11C17O18N19179.2°180.0°
C11C17N19N20179.1°175.1°
C11C17N19HN90.9°4.9°
C17C11C24H244.1°0.3°
C24C11C12C140.6°0.3°
C24C11C12H12179.3°179.8°
C24C11C17O18112.2°4.2°
C24C11C17N1967.2°175.8°
H12C12C14H140.3°0.0°
O18C17N19N200.2°4.8°
O18C17N19HN9179.8°175.2°
C17N19N20HN9180.0°180.0°
C17N19N20C21159.0°174.1°
C17N19N20HN075.7°5.8°
N19N20C21HN0125.3°179.9°
N19N20C21O229.3°178.8°
N19N20C21NK'113.3°1.1°
HN9N19N20C2121.0°5.9°
HN9N19N20HN0104.3°174.2°
N20C21O22NK'120.6°179.9°
N20C21NK'NJ'65.0°175.9°
N20C21NK'HN2115.0°4.1°
HN0N20C21O22134.6°1.3°
HN0N20C21NK'12.0°178.8°
O22C21NK'NJ'172.6°3.9°
O22C21NK'HN27.5°176.0°
C21NK'NJ'CH'159.9°175.3°
C21NK'NJ'HN2180.0°179.9°
C21NK'NJ'HN120.1°4.8°
C2'C1'C6'H1'180.0°180.0°
C1'C2'C3'H2'180.0°180.0°
C1'C2'C3'C4'0.2°0.1°
C1'C2'C3'H3'179.8°180.0°
C2'C1'C6'C5'0.2°0.2°
C2'C1'C6'H6'179.8°180.0°
C6'C1'C2'C3'0.2°0.0°
C6'C1'C2'H2'179.8°180.0°
C1'C6'C5'C4'0.2°0.5°
C1'C6'C5'H6'180.0°179.8°
C1'C6'C5'H5'179.7°180.0°
H1'C1'C2'C3'179.7°180.0°
H1'C1'C2'H2'0.2°0.0°
H1'C1'C6'C5'179.7°179.8°
H1'C1'C6'H6'0.2°0.0°
C2'C3'C4'H3'180.0°179.9°
C2'C3'C4'C5'0.2°0.3°
C2'C3'C4'C7'179.6°180.0°
H2'C2'C3'C4'179.8°179.9°
H2'C2'C3'H3'0.2°0.0°
C3'C4'C5'C7'179.8°179.6°
C3'C4'C5'C6'0.2°0.6°
C3'C4'C5'H5'179.8°179.9°
C3'C4'C7'O8'117.1°90.1°
C3'C4'C7'H7'18.1°30.0°
C3'C4'C7'H7'2117.7°149.9°
H3'C3'C4'C5'179.8°179.7°
H3'C3'C4'C7'0.4°0.1°
C4'C5'C6'H5'180.0°179.6°
C4'C5'C6'H6'179.8°179.7°
C5'C4'C7'O8'63.1°90.3°
C5'C4'C7'H7'1171.7°149.7°
C5'C4'C7'H7'262.1°29.7°
C7'C4'C5'C6'179.6°179.8°
C7'C4'C5'H5'0.4°0.3°
C4'C7'O8'H7'1125.2°120.1°
C4'C7'O8'H7'2125.2°120.0°
C4'C7'H7'1H7'2113.8°120.0°
C4'C7'O8'C9'129.6°180.0°
H5'C5'C6'H6'0.2°0.1°
O8'C7'H7'1H7'2113.7°119.9°
C7'O8'C9'OA'17.7°0.0°
C7'O8'C9'NO'161.9°180.0°
H7'1C7'O8'C9'4.4°59.9°
H7'2C7'O8'C9'105.2°60.0°
O8'C9'OA'NO'179.6°180.0°
O8'C9'NO'CB'179.4°176.8°
O8'C9'NO'HN40.7°3.1°
OA'C9'NO'CB'0.3°3.2°
OA'C9'NO'HN4179.7°176.9°
C9'NO'CB'CC'36.7°118.5°
C9'NO'CB'CH'90.8°121.5°
C9'NO'CB'HN4180.0°180.0°
C9'NO'CB'H11'156.2°1.5°
CC'CB'CH'NO'129.1°120.0°
CC'CB'CH'H11'120.2°120.0°
CC'CB'NO'H11'119.5°120.0°
CB'CC'CE'H12A125.2°120.0°
CB'CC'CE'H12B125.2°120.0°
CB'CC'H12AH12B114.4°120.1°
CB'CC'CE'CF'2.9°174.7°
CB'CC'CE'CG'119.7°65.3°
CB'CC'CE'H14'120.8°54.7°
CC'CB'CH'OI'48.1°97.0°
CC'CB'CH'NJ'130.6°82.9°
CC'CB'NO'HN4143.3°61.5°
CH'CB'NO'H11'112.9°120.1°
CH'CB'CC'CE'158.4°176.3°
CH'CB'CC'H12A76.3°56.3°
CH'CB'CC'H12B33.2°63.7°
CB'CH'OI'NJ'178.5°179.9°
CB'CH'NJ'NK'179.1°174.8°
CB'CH'NJ'HN10.9°5.2°
CH'CB'NO'HN489.1°58.4°
NO'CB'CC'CE'68.8°63.7°
NO'CB'CC'H12A56.5°176.3°
NO'CB'CC'H12B166.0°56.3°
NO'CB'CH'OI'81.0°22.9°
NO'CB'CH'NJ'100.4°157.1°
H11'CB'CC'CE'43.5°56.3°
H11'CB'CC'H12A168.7°63.7°
H11'CB'CC'H12B81.8°176.3°
H11'CB'CH'OI'168.2°143.0°
H11'CB'CH'NJ'10.4°37.1°
H11'CB'NO'HN423.8°178.5°
CE'CC'H12AH12B114.4°119.9°
CC'CE'CF'CG'121.4°120.0°
CC'CE'CF'H14'119.2°120.0°
CC'CE'CG'H14'119.4°120.0°
CC'CE'CF'H15A180.0°180.0°
CC'CE'CF'H15B54.7°60.0°
CC'CE'CF'H15C54.7°60.1°
CC'CE'CG'H16A180.0°60.0°
CC'CE'CG'H16B54.8°60.0°
CC'CE'CG'H16C54.7°180.0°
H12ACC'CE'CF'128.1°65.3°
H12ACC'CE'CG'5.5°54.8°
H12ACC'CE'H14'113.9°174.7°
H12BCC'CE'CF'122.4°54.7°
H12BCC'CE'CG'115.0°174.7°
H12BCC'CE'H14'4.4°65.3°
CF'CE'CG'H14'118.0°120.0°
CE'CF'H15AH15B125.3°120.0°
CE'CF'H15AH15C125.3°119.9°
CE'CF'H15BH15C117.5°120.0°
CF'CE'CG'H16A57.4°60.0°
CF'CE'CG'H16B67.9°180.0°
CF'CE'CG'H16C177.4°60.0°
CG'CE'CF'H15A58.6°60.0°
CG'CE'CF'H15B176.1°180.0°
CG'CE'CF'H15C66.7°60.0°
CE'CG'H16AH16B125.2°120.0°
CE'CG'H16AH16C125.3°120.0°
CE'CG'H16BH16C118.3°120.0°
H14'CE'CF'H15A60.7°60.0°
H14'CE'CF'H15B64.5°60.0°
H14'CE'CF'H15C173.9°179.9°
H14'CE'CG'H16A60.6°180.0°
H14'CE'CG'H16B174.1°60.0°
H14'CE'CG'H16C64.6°60.0°
H15ACF'H15BH15C117.5°120.0°
H16ACG'H16BH16C118.4°120.0°
OI'CH'NJ'NK'0.5°5.3°
OI'CH'NJ'HN1179.5°174.8°
CH'NJ'NK'HN1180.0°179.9°
CH'NJ'NK'HN220.2°4.6°
HN1NJ'NK'HN2159.8°175.3°

222624

PDB entries from 2024-07-17

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