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SummaryGeometryRelated PDB entries

MQF

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C01C02doub1.39Å1.39ÅAromatic
C02N03sing1.32Å1.35ÅAromatic
N03C04doub1.32Å1.36ÅAromatic
C04C05sing1.40Å1.36ÅAromatic
C01C06sing1.38Å1.38ÅAromatic
C05C06doub1.40Å1.36ÅAromatic
C02O07sing1.35Å1.37Å
C04C08sing1.51Å1.49Å
C08F09sing1.40Å1.33Å
C08F10sing1.40Å1.33Å
C08F11sing1.40Å1.34Å
O07C12sing1.43Å1.39Å
C12C13sing1.53Å1.47Å
C13F14sing1.40Å1.32Å
C13F15sing1.40Å1.34Å
C13F16sing1.40Å1.37Å
C05C17sing1.47Å1.50Å
C17O18doub1.22Å1.25Å
C17O19sing1.35Å1.27Å
C01C20sing1.51Å1.54Å
C20C21sing1.53Å1.51Å
C21C22sing1.53Å1.49Å
C22C23sing1.53Å1.45Å
C23C24sing1.53Å1.46Å
C20C25sing1.53Å1.49Å
C24C25sing1.53Å1.50Å
C06H26sing1.08Å1.08Å
C20H30sing1.09Å1.10Å
C21H32sing1.09Å1.10Å
C21H31sing1.09Å1.10Å
C22H33sing1.09Å1.10Å
C22H34sing1.09Å1.10Å
C23H36sing1.09Å1.10Å
C23H35sing1.09Å1.10Å
C24H37sing1.09Å1.10Å
C24H38sing1.09Å1.10Å
C25H40sing1.09Å1.10Å
C25H39sing1.09Å1.10Å
C12H27sing1.09Å1.10Å
C12H28sing1.09Å1.10Å
O19H1sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C01C02N03123.2°121.0°
C02C01C06115.1°119.2°
C01C02O07119.5°119.5°
C02C01C20120.3°120.4°
C02N03C04119.2°121.9°
N03C02O07117.3°119.6°
N03C04C05119.9°120.6°
N03C04C08116.2°119.7°
C04C05C06120.0°118.9°
C05C04C08123.9°119.6°
C04C05C17122.1°120.5°
C01C06C05122.5°118.4°
C06C01C20124.4°120.4°
C01C06H26118.7°120.8°
C06C05C17117.8°120.5°
C05C06H26118.8°120.8°
C02O07C12122.0°117.0°
C04C08F09107.7°109.4°
C04C08F10109.2°109.5°
C04C08F11110.5°109.5°
F09C08F10109.0°109.5°
F09C08F11112.6°109.5°
F10C08F11107.8°109.5°
O07C12C13107.3°109.5°
O07C12H27110.0°109.5°
O07C12H28110.0°109.4°
C12C13F14114.4°109.5°
C12C13F15109.8°109.4°
C12C13F16109.0°109.4°
C13C12H27110.0°109.5°
C13C12H28110.0°109.5°
F14C13F15107.6°109.5°
F14C13F16110.1°109.5°
F15C13F16105.5°109.5°
C05C17O18119.2°120.0°
C05C17O19117.1°120.0°
O18C17O19123.4°120.0°
C17O19H1109.5°117.0°
C01C20C21110.5°109.4°
C01C20C25110.2°109.5°
C01C20H30109.2°109.4°
C20C21C22115.2°109.5°
C21C20C25107.4°109.5°
C21C20H30109.6°109.4°
C20C21H32108.0°109.5°
C20C21H31108.0°109.4°
C21C22C23105.6°109.5°
C22C21H32108.0°109.5°
C22C21H31108.0°109.5°
C21C22H33110.4°109.4°
C21C22H34110.5°109.5°
C22C23C24118.2°109.4°
C23C22H33110.4°109.5°
C23C22H34110.4°109.5°
C22C23H36107.2°109.5°
C22C23H35107.3°109.5°
C23C24C25113.4°109.5°
C24C23H36107.3°109.5°
C24C23H35107.3°109.5°
C23C24H37108.5°109.5°
C23C24H38108.5°109.4°
C20C25C24111.8°109.5°
C25C20H30109.9°109.5°
C20C25H40108.9°109.4°
C20C25H39108.9°109.5°
C25C24H37108.5°109.5°
C25C24H38108.5°109.5°
C24C25H40108.9°109.4°
C24C25H39108.9°109.5°
H32C21H31109.5°109.5°
H33C22H34109.5°109.5°
H36C23H35109.5°109.4°
H37C24H38109.5°109.4°
H40C25H39109.5°109.5°
H27C12H28109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C01C02N03O07178.5°180.0°
C01C02N03C043.4°0.0°
C02C01C06C20175.3°179.7°
C02C01C06C051.7°0.0°
C01C02O07C12178.4°180.0°
C02C01C20C21132.4°120.0°
C02C01C20C25109.0°120.0°
C02C01C06H26178.4°180.0°
C02C01C20H3011.8°0.1°
C02N03C04C051.5°0.0°
N03C02C01C063.4°0.0°
C02N03C04C08179.4°180.0°
N03C02O07C123.1°0.0°
N03C02C01C20178.9°179.7°
N03C04C05C08179.1°180.0°
N03C04C05C060.2°0.0°
C04N03C02O07178.1°180.0°
N03C04C08F0993.5°5.0°
N03C04C08F1024.7°125.0°
N03C04C08F11143.1°115.0°
N03C04C05C17176.1°180.0°
C04C05C06C010.0°0.0°
C04C05C06C17176.4°180.0°
C05C04C08F0987.4°175.0°
C05C04C08F10154.4°55.0°
C05C04C08F1136.0°65.0°
C04C05C17O18123.6°0.0°
C04C05C17O1962.5°179.9°
C04C05C06H26180.0°180.0°
C01C06C05H26180.0°180.0°
C06C01C02O07178.1°180.0°
C01C06C05C17176.4°180.0°
C06C01C20C2142.7°60.3°
C06C01C20C2575.9°59.7°
C06C01C20H30163.3°179.7°
C06C05C04C08178.9°180.0°
C06C05C17O1860.1°180.0°
C06C05C17O19113.8°0.0°
C05C06C01C20177.0°179.7°
C02O07C12C13107.3°180.0°
O07C02C01C202.6°0.3°
C02O07C12H2712.4°59.9°
C02O07C12H28133.0°60.0°
C04C08F09F10118.3°120.0°
C04C08F09F11122.1°120.0°
C04C08F10F11120.1°120.0°
C08C04C05C174.9°0.0°
F09C08F10F11122.5°120.0°
O07C12C13H27119.6°120.0°
O07C12C13H28119.6°120.0°
O07C12C13F1459.1°60.0°
O07C12C13F15179.9°180.0°
O07C12C13F1664.7°60.1°
O07C12H27H28121.0°119.9°
C12C13F14F15122.3°120.0°
C12C13F14F16123.2°120.0°
C12C13F15F16117.4°119.9°
C13C12H27H28121.0°120.0°
F14C13F15F16117.6°120.1°
F14C13C12H27178.7°180.0°
F14C13C12H2860.6°60.0°
F15C13C12H2760.2°60.0°
F15C13C12H2860.5°60.0°
F16C13C12H2755.0°60.0°
F16C13C12H28175.7°180.0°
C05C17O18O19173.5°180.0°
C17C05C06H263.6°0.1°
C05C17O19H1173.7°180.0°
O18C17O19H10.0°0.1°
C01C20C21C25120.3°120.0°
C01C20C21H30120.3°119.9°
C01C20C21C22178.4°180.0°
C01C20C25H30120.3°120.0°
C01C20C25C24173.4°180.0°
C20C01C06H263.0°0.3°
C01C20C21H3257.5°59.9°
C01C20C21H3160.8°60.0°
C01C20C25H4053.0°60.0°
C01C20C25H3966.3°60.0°
C20C21C22H32120.9°120.0°
C20C21C22H31120.8°119.9°
C20C21C22C2357.7°60.0°
C21C20C25H30119.1°120.0°
C21C20C25C2452.8°60.0°
C20C21H32H31117.4°119.9°
C20C21C22H3361.7°60.1°
C20C21C22H34177.1°180.0°
C21C20C25H4067.5°60.0°
C21C20C25H39173.2°180.0°
C21C22C23H33119.4°120.0°
C21C22C23H34119.4°120.0°
C21C22C23C2450.4°60.0°
C22C21C20C2561.3°60.0°
C22C21C20H3058.1°60.1°
C22C21H32H31117.4°120.0°
C21C22H33H34121.8°119.9°
C21C22C23H36171.7°180.0°
C21C22C23H3570.8°60.0°
C22C23C24H36121.2°120.0°
C22C23C24H35121.3°120.0°
C22C23C24C2548.4°60.0°
C23C22C21H32178.6°180.0°
C23C22C21H3163.1°60.0°
C23C22H33H34121.8°120.0°
C22C23H36H35116.1°120.0°
C22C23C24H3772.2°60.1°
C22C23C24H38169.0°180.0°
C23C24C25C2047.9°60.0°
C23C24C25H37120.6°120.0°
C23C24C25H38120.6°120.0°
C24C23C22H3368.9°60.0°
C24C23C22H34169.8°180.0°
C24C23H36H35116.1°120.0°
C23C24H37H38118.2°119.9°
C23C24C25H4072.5°60.0°
C23C24C25H39168.2°180.0°
C20C25C24H40120.3°119.9°
C20C25C24H39120.3°120.0°
C25C20C21H32177.9°180.0°
C25C20C21H3159.6°60.0°
C20C25C24H3772.7°60.1°
C20C25C24H38168.5°180.0°
C20C25H40H39119.0°120.0°
C24C25C20H3066.3°60.0°
C25C24C23H36169.6°180.0°
C25C24C23H3572.9°60.0°
C25C24H37H38118.2°120.0°
C24C25H40H39118.9°120.0°
H30C20C21H3262.8°60.0°
H30C20C21H31178.9°180.0°
H30C20C25H40173.4°180.0°
H30C20C25H3954.0°60.0°
H32C21C22H3359.2°60.0°
H32C21C22H3462.1°60.0°
H31C21C22H33177.5°180.0°
H31C21C22H3456.2°60.1°
H33C22C23H3652.3°60.0°
H33C22C23H35169.8°180.0°
H34C22C23H3668.9°60.0°
H34C22C23H3548.6°60.0°
H36C23C24H3749.0°59.9°
H36C23C24H3869.8°59.9°
H35C23C24H37166.5°179.9°
H35C23C24H3847.7°60.1°
H37C24C25H40167.0°180.0°
H37C24C25H3947.6°60.0°
H38C24C25H4048.1°60.0°
H38C24C25H3971.2°60.0°

222415

PDB entries from 2024-07-10

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