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TEM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1C2sing1.43Å1.23Å
O1HO1sing0.97Å0.95Å
C2C3sing1.53Å1.53Å
C2C9sing1.53Å1.52Å
C2H2sing1.09Å1.11Å
C3N4sing1.46Å1.47Å
C3H31sing1.09Å1.12Å
C3H32sing1.09Å1.11Å
N4C5sing1.36Å1.43Å
N4HN4sing0.97Å1.02Å
C5C6doub1.35Å1.34Å
C5H5sing1.08Å1.10Å
C6C7sing1.40Å1.49Å
C6H6sing1.08Å1.10Å
C7O8doub1.21Å1.22Å
C7H7sing1.08Å1.10Å
C9C10sing1.51Å1.52Å
C9H91sing1.09Å1.12Å
C9H92sing1.09Å1.12Å
C10O11doub1.21Å1.43Å
C10H10sing1.08Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2O1HO1119.5°106.8°
O1C2C3119.5°109.5°
O1C2C9123.1°109.4°
O1C2H263.1°109.5°
C3C2C9117.3°109.5°
C3C2H2126.3°109.4°
C2C3N4108.4°109.5°
C2C3H31112.6°109.5°
C2C3H32112.6°109.5°
C9C2H286.9°109.5°
C2C9C10110.4°109.5°
C2C9H91111.9°109.4°
C2C9H92111.9°109.5°
N4C3H31112.6°109.5°
N4C3H32112.6°109.5°
C3N4C5117.0°120.1°
C3N4HN4109.4°119.9°
H31C3H3297.8°109.4°
C5N4HN4109.5°120.0°
N4C5C6131.6°120.1°
N4C5H5118.2°119.9°
C6C5H5110.2°120.0°
C5C6C7117.8°120.1°
C5C6H6116.1°120.0°
C7C6H6126.1°120.0°
C6C7O8121.4°120.0°
C6C7H7129.3°120.0°
O8C7H7109.3°120.0°
C10C9H91111.9°109.5°
C10C9H92111.9°109.4°
C9C10O11113.9°120.0°
C9C10H10125.8°120.0°
H91C9H9298.5°109.5°
O11C10H10120.3°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C2C3C9175.7°120.0°
O1C2C3H276.7°120.0°
O1C2C9H254.8°120.0°
O1C2C3N42.6°60.0°
O1C2C3H31122.6°60.0°
O1C2C3H32127.9°180.0°
O1C2C9C1042.7°60.0°
O1C2C9H91168.0°180.0°
O1C2C9H9282.6°60.0°
HO1O1C2C3180.0°60.0°
HO1O1C2C94.5°60.0°
HO1O1C2H261.7°180.0°
C3C2C9H2129.7°120.0°
C2C3N4H31125.2°120.0°
C2C3N4H32125.3°120.1°
C2C3H31H32118.5°120.0°
C2C3N4C589.3°180.0°
C2C3N4HN4145.4°0.1°
C3C2C9C10141.8°180.0°
C3C2C9H9116.5°60.0°
C3C2C9H9292.9°60.0°
C9C2C3N4178.3°180.0°
C9C2C3H3153.1°60.0°
C9C2C3H3256.4°60.0°
C2C9C10H91125.3°120.0°
C2C9C10H92125.3°120.0°
C2C9H91H92117.8°120.0°
C2C9C10O1160.4°120.0°
C2C9C10H10119.7°59.9°
H2C2C3N474.1°60.0°
H2C2C3H31160.7°180.0°
H2C2C3H3251.3°60.0°
H2C2C9C1012.1°60.0°
H2C2C9H91113.2°60.0°
H2C2C9H92137.4°180.0°
N4C3H31H32118.5°120.0°
C3N4C5HN4125.2°179.9°
C3N4C5C621.6°180.0°
C3N4C5H5158.4°0.0°
H31C3N4C5145.5°60.0°
H31C3N4HN420.2°120.1°
H32C3N4C536.0°59.9°
H32C3N4HN489.3°120.0°
N4C5C6H5180.0°180.0°
N4C5C6C7177.4°180.0°
N4C5C6H62.6°0.0°
HN4N4C5C6146.8°0.0°
HN4N4C5H533.2°180.0°
C5C6C7H6180.0°180.0°
C5C6C7O8178.0°180.0°
C5C6C7H72.0°0.0°
H5C5C6C72.6°0.0°
H5C5C6H6177.4°NaN°
C6C7O8H7180.0°180.0°
H6C6C7O82.0°0.0°
H6C6C7H7178.0°180.0°
C10C9H91H92117.8°120.0°
C9C10O11H10180.0°179.9°
H91C9C10O11174.4°0.0°
H91C9C10H105.6°179.9°
H92C9C10O1164.9°120.0°
H92C9C10H10115.0°60.1°

221716

PDB entries from 2024-06-26

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