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F89

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O1Adoub1.22Å1.23Å
C1N2sing1.35Å1.35ÅAromatic
C1C1Asing1.46Å1.42ÅAromatic
N2C3sing1.36Å1.35ÅAromatic
N2HN2sing0.97Å1.02Å
C3C3Msing1.51Å1.49Å
C3N4doub1.30Å1.34ÅAromatic
C3MH3M1sing1.09Å1.12Å
C3MH3M2sing1.09Å1.11Å
C3MH3M3sing1.09Å1.12Å
N4C4Asing1.35Å1.34ÅAromatic
C4AC5doub1.41Å1.40ÅAromatic
C4AC1Asing1.41Å1.42ÅAromatic
C5C6sing1.35Å1.39ÅAromatic
C5H5sing1.08Å1.10Å
C6C6Adoub1.41Å1.39ÅAromatic
C6H6sing1.08Å1.10Å
C6AC7sing1.40Å1.40ÅAromatic
C6AC1Bsing1.42Å1.43ÅAromatic
C7C8doub1.36Å1.39ÅAromatic
C7H7sing1.08Å1.10Å
C8C9sing1.39Å1.40ÅAromatic
C8H8sing1.08Å1.10Å
C9C10doub1.36Å1.41ÅAromatic
C9C11sing1.51Å1.48Å
C10C1Bsing1.40Å1.42ÅAromatic
C10H10sing1.08Å1.10Å
C1BC1Adoub1.46Å1.43ÅAromatic
C11N12sing1.47Å1.46Å
C11H111sing1.09Å1.12Å
C11H112sing1.09Å1.11Å
N12C13sing1.39Å1.45Å
N12HN12sing0.97Å1.02Å
C13C14doub1.39Å1.41ÅAromatic
C13C18sing1.39Å1.41ÅAromatic
C14C15sing1.37Å1.40ÅAromatic
C14H14sing1.08Å1.10Å
C15C16doub1.40Å1.39ÅAromatic
C15C19sing1.51Å1.45Å
C16C17sing1.40Å1.40ÅAromatic
C16Csing1.47Å1.46Å
C17C18doub1.38Å1.42ÅAromatic
C17H17sing1.08Å1.10Å
C18H18sing1.08Å1.10Å
C19Nsing1.47Å1.45Å
C19H191sing1.09Å1.11Å
C19H192sing1.09Å1.12Å
COdoub1.22Å1.24Å
CNsing1.34Å1.34Å
NCAsing1.47Å1.46Å
CACTsing1.51Å1.54Å
CACBsing1.53Å1.55Å
CAHAsing1.09Å1.12Å
CTO1doub1.21Å1.23Å
CTO2sing1.34Å1.23Å
O2HO2sing0.97Å0.95Å
CBCGsing1.53Å1.53Å
CBHB1sing1.09Å1.12Å
CBHB2sing1.09Å1.11Å
CGCDsing1.51Å1.52Å
CGHG1sing1.09Å1.12Å
CGHG2sing1.09Å1.12Å
CDOE1doub1.21Å1.23Å
CDOE2sing1.34Å1.23Å
OE2HOE2sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1AC1N2117.6°121.3°
O1AC1C1A123.1°121.3°
N2C1C1A119.2°117.4°
C1N2C3122.1°120.3°
C1N2HN2119.0°119.9°
C1C1AC4A115.3°118.4°
C1C1AC1B126.5°122.4°
C3N2HN2118.9°119.8°
N2C3C3M120.6°118.3°
N2C3N4119.8°123.3°
C3MC3N4119.6°118.4°
C3C3MH3M1120.6°109.4°
C3C3MH3M2108.2°109.5°
C3C3MH3M3108.2°109.5°
C3N4C4A121.0°121.8°
H3M1C3MH3M2108.2°109.4°
H3M1C3MH3M3108.2°109.5°
H3M2C3MH3M3101.8°109.5°
N4C4AC5119.5°121.4°
N4C4AC1A121.0°118.8°
C5C4AC1A119.5°119.8°
C4AC5C6116.5°121.4°
C4AC5H5121.9°119.3°
C4AC1AC1B118.2°119.2°
C6C5H5121.5°119.3°
C5C6C6A116.5°121.4°
C5C6H6121.7°119.3°
C6AC6H6121.8°119.3°
C6C6AC7119.0°121.2°
C6C6AC1B119.6°119.7°
C7C6AC1B121.4°119.1°
C6AC7C8119.9°119.8°
C6AC7H7120.1°120.1°
C6AC1BC10117.5°119.6°
C6AC1BC1A118.3°118.5°
C8C7H7120.0°120.1°
C7C8C9120.3°120.9°
C7C8H8119.5°119.5°
C9C8H8120.2°119.6°
C8C9C10119.8°120.9°
C8C9C11119.1°119.6°
C10C9C11121.1°119.6°
C9C10C1B120.6°119.7°
C9C10H10119.6°120.1°
C9C11N12113.1°109.5°
C9C11H111110.8°109.5°
C9C11H112110.9°109.5°
C1BC10H10119.8°120.2°
C10C1BC1A124.2°121.9°
N12C11H111110.9°109.5°
N12C11H112110.9°109.5°
C11N12C13121.7°120.0°
C11N12HN12107.8°119.9°
H111C11H11299.4°109.4°
C13N12HN12107.9°120.0°
N12C13C14120.3°120.0°
N12C13C18120.3°120.0°
C14C13C18119.4°120.0°
C13C14C15119.1°119.9°
C13C14H14120.7°120.1°
C13C18C17121.1°120.2°
C13C18H18119.2°119.9°
C15C14H14120.2°120.0°
C14C15C16121.8°120.4°
C14C15C19131.2°133.2°
C16C15C19107.0°106.4°
C15C16C17120.3°119.5°
C15C16C108.8°108.2°
C15C19N106.4°106.2°
C15C19H191113.3°110.1°
C15C19H192113.3°110.1°
C17C16C130.8°132.3°
C16C17C18118.3°120.0°
C16C17H17120.4°120.0°
C16CO125.9°124.8°
C16CN108.0°110.4°
C18C17H17121.3°120.0°
C17C18H18119.7°119.9°
NC19H191113.4°110.1°
NC19H192113.4°110.1°
C19NC109.8°108.7°
C19NCA120.0°125.6°
H191C19H19297.1°110.1°
OCN126.0°124.8°
CNCA127.9°125.6°
NCACT111.5°109.5°
NCACB108.8°109.4°
NCAHA109.6°109.5°
CTCACB112.5°109.5°
CTCAHA105.8°109.5°
CACTO1121.7°120.0°
CACTO2118.6°120.0°
CBCAHA108.6°109.5°
CACBCG115.1°109.5°
CACBHB1110.1°109.5°
CACBHB2110.2°109.4°
O1CTO2119.6°120.0°
CTO2HO2118.6°120.1°
CGCBHB1110.2°109.5°
CGCBHB2110.1°109.5°
CBCGCD117.8°109.5°
CBCGHG1109.2°109.5°
CBCGHG2109.2°109.5°
HB1CBHB2100.1°109.4°
CDCGHG1109.2°109.4°
CDCGHG2109.2°109.5°
CGCDOE1121.3°120.0°
CGCDOE2117.5°120.0°
HG1CGHG2100.9°109.5°
OE1CDOE2121.0°120.0°
CDOE2HOE2117.6°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1AC1N2C1A177.1°179.7°
O1AC1N2C3165.6°179.7°
O1AC1N2HN214.3°0.3°
O1AC1C1AC4A162.0°180.0°
O1AC1C1AC1B17.0°0.1°
C1N2C3HN2180.0°179.3°
C1N2C3C3M177.3°179.7°
C1N2C3N42.0°0.7°
N2C1C1AC4A14.9°0.4°
N2C1C1AC1B166.0°179.6°
C1AC1N2C311.5°0.6°
C1AC1N2HN2168.6°180.0°
C1C1AC4AN410.1°0.0°
C1C1AC4AC5169.1°180.0°
C1C1AC4AC1B179.1°180.0°
C1C1AC1BC6A179.6°179.9°
C1C1AC1BC101.7°0.1°
N2C3C3MN4179.3°179.7°
N2C3C3MH3M1180.0°179.7°
N2C3C3MH3M254.8°60.3°
N2C3C3MH3M354.8°59.7°
N2C3N4C4A3.2°0.3°
HN2N2C3C3M2.7°0.3°
HN2N2C3N4178.0°180.0°
C3C3MH3M1H3M2125.3°120.0°
C3C3MH3M1H3M3125.2°120.0°
C3C3MH3M2H3M3113.8°120.0°
C3MC3N4C4A177.5°180.0°
N4C3C3MH3M10.7°0.0°
N4C3C3MH3M2126.0°120.0°
N4C3C3MH3M3124.5°120.0°
C3N4C4AC5177.9°179.9°
C3N4C4AC1A1.2°0.0°
H3M1C3MH3M2H3M3113.9°120.0°
N4C4AC5C1A179.2°179.9°
N4C4AC5C6149.6°180.0°
N4C4AC5H530.4°0.0°
N4C4AC1AC1B170.8°179.9°
C4AC5C6H5180.0°180.0°
C4AC5C6C6A40.7°0.0°
C4AC5C6H6139.4°180.0°
C5C4AC1AC1B10.1°0.0°
C1AC4AC5C631.2°0.1°
C1AC4AC5H5148.8°180.0°
C4AC1AC1BC6A1.4°0.1°
C4AC1AC1BC10177.4°179.9°
C5C6C6AH6179.9°180.0°
C5C6C6AC7150.7°180.0°
C5C6C6AC1B29.5°0.1°
H5C5C6C6A139.3°180.0°
H5C5C6H640.6°0.0°
C6C6AC7C1B179.7°179.9°
C6C6AC7C8178.7°180.0°
C6C6AC7H71.3°0.1°
C6C6AC1BC10172.7°180.0°
C6C6AC1BC1A8.4°0.2°
H6C6C6AC729.2°0.0°
H6C6C6AC1B150.5°179.9°
C6AC7C8H7180.0°180.0°
C6AC7C8C94.2°0.0°
C6AC7C8H8175.7°180.0°
C7C6AC1BC107.0°0.1°
C7C6AC1BC1A171.8°179.9°
C1BC6AC7C81.0°0.1°
C1BC6AC7H7178.9°180.0°
C6AC1BC10C97.9°0.1°
C6AC1BC10C1A178.7°179.8°
C6AC1BC10H10172.1°179.9°
C7C8C9H8179.9°180.0°
C7C8C9C103.3°0.1°
C7C8C9C11175.7°179.9°
H7C7C8C9175.8°179.9°
H7C7C8H84.3°0.0°
C8C9C10C11179.0°180.0°
C8C9C10C1B2.9°0.0°
C8C9C10H10177.1°180.0°
C8C9C11N1245.4°90.0°
C8C9C11H11179.8°150.0°
C8C9C11H112170.7°30.0°
H8C8C9C10176.6°180.0°
H8C8C9C114.3°0.0°
C9C10C1BH10180.0°180.0°
C9C10C1BC1A170.9°179.9°
C10C9C11N12133.6°90.0°
C10C9C11H111101.2°30.0°
C10C9C11H1128.3°150.0°
C11C9C10C1B178.1°180.0°
C11C9C10H101.9°0.0°
C9C11N12H111125.2°120.0°
C9C11N12H112125.3°120.0°
C9C11H111H112116.8°120.0°
C9C11N12C1384.8°180.0°
C9C11N12HN12149.9°0.0°
H10C10C1BC1A9.1°0.1°
N12C11H111H112116.8°120.0°
C11N12C13HN12125.3°179.9°
C11N12C13C1427.8°179.7°
C11N12C13C18152.1°0.1°
H111C11N12C13150.0°59.9°
H111C11N12HN1224.6°120.0°
H112C11N12C1340.5°60.0°
H112C11N12HN1284.8°120.0°
N12C13C14C18179.9°179.7°
N12C13C14C15177.8°179.8°
N12C13C14H142.2°0.3°
N12C13C18C17178.6°180.0°
N12C13C18H181.4°0.1°
HN12N12C13C14153.1°0.3°
HN12N12C13C1826.8°180.0°
C13C14C15H14180.0°179.5°
C13C14C15C161.6°0.5°
C13C14C15C19177.7°179.8°
C14C13C18C171.2°0.3°
C14C13C18H18178.7°179.8°
C18C13C14C152.0°0.5°
C18C13C14H14177.9°180.0°
C13C18C17C160.1°0.1°
C13C18C17H18180.0°179.9°
C13C18C17H17179.8°180.0°
C14C15C16C19179.4°179.7°
C14C15C16C170.2°0.3°
C14C15C16C179.1°179.7°
C14C15C19N178.1°179.7°
C14C15C19H19152.8°60.5°
C14C15C19H19256.6°61.1°
H14C14C15C16178.4°180.0°
H14C14C15C192.3°0.4°
C15C16C17C178.7°180.0°
C15C16C17C180.6°0.1°
C15C16C17H17179.3°180.0°
C16C15C19N1.2°0.0°
C16C15C19H191126.5°119.2°
C16C15C19H192124.1°119.2°
C15C16CO178.8°180.0°
C15C16CN0.9°0.0°
C19C15C16C17179.2°180.0°
C19C15C16C0.3°0.0°
C15C19NH191125.2°119.2°
C15C19NH192125.2°119.2°
C15C19H191H192119.2°121.7°
C15C19NC1.8°0.0°
C15C19NCA165.8°180.0°
C16C17C18H17180.0°180.0°
C16C17C18H18179.9°180.0°
C17C16CO0.1°0.0°
C17C16CN177.9°179.9°
CC16C17C18178.0°180.0°
CC16C17H172.0°0.0°
C16CNC191.6°0.0°
C16CON177.6°179.9°
C16CNCA164.1°180.0°
H17C17C18H180.1°0.0°
NC19H191H192119.4°121.6°
C19NCO179.6°180.0°
C19NCCA162.4°179.9°
C19NCACT122.1°120.0°
C19NCACB113.3°120.0°
C19NCAHA5.3°0.1°
H191C19NC127.0°119.2°
H191C19NCA68.9°60.7°
H192C19NC123.4°119.2°
H192C19NCA40.6°60.8°
OCNCA18.0°0.1°
CNCACT77.1°59.9°
CNCACB47.5°60.0°
CNCAHA166.1°180.0°
NCACTCB122.5°119.9°
NCACTHA119.1°120.0°
NCACBHA119.3°120.0°
NCACTO1140.9°150.0°
NCACTO240.7°29.9°
NCACBCG64.9°60.0°
NCACBHB160.4°60.0°
NCACBHB2169.9°180.0°
CTCACBHA116.7°120.1°
CACTO1O2178.4°180.0°
CACTO2HO2180.0°180.0°
CTCACBCG171.1°180.0°
CTCACBHB163.6°59.9°
CTCACBHB245.9°60.0°
CBCACTO118.4°90.0°
CBCACTO2163.2°90.0°
CACBCGHB1125.2°120.0°
CACBCGHB2125.3°120.0°
CACBHB1HB2116.0°119.9°
CACBCGCD73.8°179.9°
CACBCGHG151.5°60.0°
CACBCGHG2161.0°60.1°
HACACTO1100.0°30.0°
HACACTO278.4°150.0°
HACACBCG54.4°59.9°
HACACBHB1179.6°180.0°
HACACBHB270.8°60.1°
O1CTO2HO21.5°0.1°
CGCBHB1HB2116.0°120.0°
CBCGCDHG1125.3°120.0°
CBCGCDHG2125.3°120.0°
CBCGHG1HG2115.0°120.0°
CBCGCDOE151.1°0.0°
CBCGCDOE2133.0°180.0°
HB1CBCGCD161.0°60.0°
HB1CBCGHG173.7°180.0°
HB1CBCGHG235.7°60.0°
HB2CBCGCD51.5°60.0°
HB2CBCGHG1176.8°60.0°
HB2CBCGHG273.8°180.0°
CDCGHG1HG2114.9°120.0°
CGCDOE1OE2175.8°180.0°
CGCDOE2HOE2180.0°180.0°
HG1CGCDOE174.2°119.9°
HG1CGCDOE2101.7°60.1°
HG2CGCDOE1176.4°120.0°
HG2CGCDOE27.7°59.9°
OE1CDOE2HOE24.0°0.0°

218853

PDB entries from 2024-04-24

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