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KMH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCBsing1.47Å1.46Å
CBCGsing1.53Å1.52Å
CBCAsing1.53Å1.52Å
CEOF2sing1.34Å1.24Å
CEOF1doub1.21Å1.25Å
CEC2sing1.51Å1.53Å
CACsing1.51Å1.53Å
COdoub1.21Å1.24Å
CC2sing1.51Å1.53Å
OF2HF2sing0.97Å0.95Å
NHN1sing1.01Å1.00Å
NHN2sing1.01Å1.00Å
CBHBsing1.09Å1.10Å
CGHG1Csing1.09Å1.10Å
CGHG2Csing1.09Å1.10Å
CGHG3Csing1.09Å1.10Å
CAHA1Csing1.09Å1.10Å
CAHA2Csing1.09Å1.10Å
C2H21Csing1.09Å1.10Å
C2H22Csing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NCBCG109.3°109.5°
NCBCA107.0°109.5°
CBNHN1109.5°111.0°
CBNHN2109.5°111.0°
NCBHB111.7°109.5°
CGCBCA110.8°109.4°
CGCBHB107.9°109.4°
CBCGHG1C109.5°109.5°
CBCGHG2C109.5°109.5°
CBCGHG3C109.4°109.5°
CBCAC109.6°109.5°
CACBHB110.2°109.5°
CBCAHA1C109.4°109.4°
CBCAHA2C109.4°109.5°
OF2CEOF1125.6°120.0°
OF2CEC2117.3°120.0°
CEOF2HF2109.5°117.0°
OF1CEC2117.1°120.0°
CEC2C110.1°109.5°
CEC2H21C109.2°109.5°
CEC2H22C109.1°109.5°
CACO121.5°120.0°
CACC2116.5°120.0°
CCAHA1C109.4°109.5°
CCAHA2C109.4°109.5°
OCC2122.0°120.0°
CC2H21C109.3°109.4°
CC2H22C109.1°109.4°
HN1NHN2109.4°110.9°
HG1CCGHG2C109.4°109.5°
HG1CCGHG3C109.5°109.4°
HG2CCGHG3C109.5°109.5°
HA1CCAHA2C109.6°109.5°
H21CC2H22C110.0°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NCBCGCA117.7°120.0°
NCBCGHB121.7°120.0°
NCBCAHB121.6°120.1°
NCBCAC77.0°65.0°
CBNHN1HN2120.0°124.0°
NCBCGHG1C117.8°59.9°
NCBCGHG2C122.2°180.0°
NCBCGHG3C2.1°60.0°
NCBCAHA1C162.9°175.0°
NCBCAHA2C42.9°55.0°
CGCBCAHB119.4°120.0°
CGCBCAC163.9°175.0°
CGCBNHN134.1°176.1°
CGCBNHN285.9°60.0°
CBCGHG1CHG2C120.0°120.1°
CBCGHG1CHG3C120.0°119.9°
CBCGHG2CHG3C120.0°120.0°
CGCBCAHA1C43.9°55.0°
CGCBCAHA2C76.1°65.0°
CBCACHA1C120.0°120.0°
CBCACHA2C119.9°120.0°
CBCACO55.3°0.0°
CBCACC2124.4°180.0°
CACBNHN185.9°64.0°
CACBNHN2154.1°60.0°
CACBCGHG1C0.2°60.1°
CACBCGHG2C120.1°60.0°
CACBCGHG3C119.8°180.0°
CBCAHA1CHA2C119.9°120.0°
OF2CEOF1C2178.2°179.9°
OF2CEC2C136.7°180.0°
OF2CEC2H21C16.7°60.0°
OF2CEC2H22C103.5°60.1°
OF1CEC2C41.6°0.1°
OF1CEOF2HF20.0°0.1°
OF1CEC2H21C161.6°120.0°
OF1CEC2H22C78.1°120.0°
CEC2CCA110.4°180.0°
CEC2CO69.9°0.0°
CEC2CH21C120.0°120.1°
CEC2CH22C119.7°120.0°
C2CEOF2HF2178.2°180.0°
CEC2H21CH22C119.7°120.0°
CACOC2179.6°180.0°
CCACBHB44.6°55.0°
CCAHA1CHA2C120.0°120.0°
CACC2H21C9.6°60.0°
CACC2H22C129.8°60.0°
OCCAHA1C175.3°120.0°
OCCAHA2C64.7°120.0°
OCC2H21C170.1°120.1°
OCC2H22C49.8°120.0°
C2CCAHA1C4.4°60.0°
C2CCAHA2C115.7°60.0°
CC2H21CH22C119.8°119.9°
HN1NCBHB153.5°56.1°
HN2NCBHB33.5°180.0°
HBCBCGHG1C120.5°180.0°
HBCBCGHG2C0.6°60.0°
HBCBCGHG3C119.5°60.1°
HBCBCAHA1C75.5°65.0°
HBCBCAHA2C164.5°175.0°
HG1CCGHG2CHG3C120.0°119.9°

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PDB entries from 2024-09-25

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