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NG2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C38C37sing1.53Å1.56Å
C37N34sing1.47Å1.32Å
N34C35sing1.47Å1.36Å
N34C33sing1.47Å1.37Å
C35C36sing1.53Å1.52Å
F28C25sing1.40Å1.34Å
C36N31sing1.47Å1.34Å
C33C32sing1.53Å1.53Å
C32N31sing1.47Å1.37Å
F26C25sing1.40Å1.31Å
C25F27sing1.40Å1.32Å
C25C24sing1.51Å1.55Å
N31C30sing1.47Å1.33Å
C30C23sing1.51Å1.57Å
C24C23doub1.38Å1.43ÅAromatic
C24C29sing1.38Å1.39ÅAromatic
C23C22sing1.38Å1.40ÅAromatic
C29C20doub1.39Å1.40ÅAromatic
O39C18doub1.22Å1.19Å
C22C21doub1.38Å1.40ÅAromatic
C16C15doub1.34Å1.39ÅAromatic
C16N17sing1.37Å1.33ÅAromatic
C20C21sing1.39Å1.39ÅAromatic
C20N19sing1.40Å1.42Å
C15C14sing1.46Å1.44ÅAromatic
N17C13sing1.37Å1.37ÅAromatic
C18N19sing1.35Å1.43Å
C18C05sing1.48Å1.51Å
C14C13doub1.41Å1.38ÅAromatic
C14C09sing1.40Å1.43ÅAromatic
C13N12sing1.33Å1.35ÅAromatic
C06C05doub1.40Å1.40ÅAromatic
C06C07sing1.38Å1.38ÅAromatic
O08C09sing1.36Å1.39Å
O08C07sing1.36Å1.39Å
C09C10doub1.39Å1.41ÅAromatic
N12C11doub1.32Å1.34ÅAromatic
C05C04sing1.40Å1.41ÅAromatic
C07C02doub1.39Å1.40ÅAromatic
C11C10sing1.38Å1.40ÅAromatic
C04C03doub1.38Å1.40ÅAromatic
C02C03sing1.38Å1.41ÅAromatic
C02C01sing1.51Å1.55Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C03H4sing1.08Å1.08Å
C04H5sing1.08Å1.08Å
C06H6sing1.08Å1.08Å
C10H7sing1.08Å1.08Å
C11H8sing1.08Å1.08Å
C15H9sing1.08Å1.08Å
C16H10sing1.08Å1.08Å
N17H11sing0.97Å1.00Å
N19H12sing0.97Å1.00Å
C21H13sing1.08Å1.08Å
C22H14sing1.08Å1.08Å
C29H15sing1.08Å1.08Å
C30H16sing1.09Å1.10Å
C30H17sing1.09Å1.10Å
C32H19sing1.09Å1.10Å
C32H20sing1.09Å1.10Å
C33H21sing1.09Å1.10Å
C33H22sing1.09Å1.10Å
C35H24sing1.09Å1.10Å
C35H25sing1.09Å1.10Å
C36H26sing1.09Å1.10Å
C36H27sing1.09Å1.10Å
C37H28sing1.09Å1.10Å
C37H29sing1.09Å1.10Å
C38H30sing1.09Å1.10Å
C38H31sing1.09Å1.10Å
C38H32sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C38C37N34115.3°109.5°
C38C37H28108.0°109.5°
C38C37H29108.0°109.5°
C37C38H30109.5°109.5°
C37C38H31109.5°109.5°
C37C38H32109.5°109.4°
C37N34C35109.8°111.0°
C37N34C33114.0°111.0°
N34C37H28108.0°109.4°
N34C37H29108.0°109.5°
C35N34C33111.6°110.8°
N34C35C36115.5°109.4°
N34C35H24108.0°109.4°
N34C35H25108.0°109.5°
N34C33C32112.5°109.4°
N34C33H21108.7°109.5°
N34C33H22108.7°109.6°
C35C36N31110.2°109.3°
C36C35H24107.9°109.5°
C36C35H25107.9°109.5°
C35C36H26109.3°109.5°
C35C36H27109.3°109.5°
F28C25F26110.1°109.5°
F28C25F27108.2°109.5°
F28C25C24108.2°109.5°
C36N31C32112.2°110.9°
C36N31C30112.2°111.0°
N31C36H26109.3°109.5°
N31C36H27109.3°109.5°
C33C32N31113.6°109.4°
C33C32H19108.5°109.5°
C33C32H20108.4°109.5°
C32C33H21108.7°109.5°
C32C33H22108.7°109.5°
C32N31C30110.9°111.0°
N31C32H19108.4°109.5°
N31C32H20108.4°109.5°
F26C25F27106.3°109.5°
F26C25C24110.5°109.5°
F27C25C24113.6°109.5°
C25C24C23121.0°120.0°
C25C24C29118.9°120.0°
N31C30C23111.2°109.5°
N31C30H16109.0°109.5°
N31C30H17109.0°109.5°
C30C23C24123.1°119.9°
C30C23C22119.0°120.0°
C23C30H16109.1°109.5°
C23C30H17109.0°109.5°
C23C24C29120.1°120.1°
C24C23C22117.9°120.1°
C24C29C20120.7°120.0°
C24C29H15119.7°120.1°
C23C22C21121.3°120.1°
C23C22H14119.3°119.9°
C29C20C21119.6°119.8°
C29C20N19122.1°120.1°
C20C29H15119.6°120.0°
O39C18N19123.0°120.0°
O39C18C05117.3°120.0°
C22C21C20120.3°120.0°
C22C21H13119.9°120.0°
C21C22H14119.3°120.0°
C15C16N17108.5°109.8°
C16C15C14106.1°106.8°
C16C15H9127.0°126.6°
C15C16H10125.8°125.1°
C16N17C13111.2°110.1°
N17C16H10125.7°125.1°
C16N17H11124.4°124.9°
C21C20N19117.8°120.1°
C20C21H13119.8°120.0°
C20N19C18127.5°120.0°
C20N19H12116.2°120.0°
C15C14C13106.9°106.3°
C15C14C09135.5°134.3°
C14C15H9126.9°126.5°
N17C13C14107.4°107.0°
N17C13N12130.6°133.2°
C13N17H11124.4°125.0°
N19C18C05119.6°120.0°
C18N19H12116.3°120.0°
C18C05C06117.5°120.1°
C18C05C04121.2°120.1°
C13C14C09117.6°119.4°
C14C13N12122.1°119.8°
C14C09O08115.4°121.0°
C14C09C10120.4°117.9°
C13N12C11120.3°121.9°
C05C06C07118.9°119.8°
C06C05C04121.1°119.7°
C05C06H6120.5°120.1°
C06C07O08118.9°120.0°
C06C07C02121.6°120.0°
C07C06H6120.6°120.1°
C09O08C07116.2°118.0°
O08C09C10124.2°121.1°
O08C07C02119.5°120.0°
C09C10C11116.9°119.4°
C09C10H7121.5°120.3°
N12C11C10122.7°121.6°
N12C11H8118.7°119.2°
C05C04C03119.3°120.0°
C05C04H5120.4°120.0°
C07C02C03119.5°120.3°
C07C02C01119.0°119.8°
C11C10H7121.6°120.3°
C10C11H8118.7°119.2°
C04C03C02119.7°120.2°
C04C03H4120.2°119.9°
C03C04H5120.4°120.0°
C03C02C01121.5°119.9°
C02C03H4120.2°119.9°
C02C01H1109.5°109.4°
C02C01H2109.5°109.5°
C02C01H3109.5°109.5°
H1C01H2109.5°109.5°
H1C01H3109.5°109.5°
H2C01H3109.5°109.5°
H16C30H17109.5°109.4°
H19C32H20109.5°109.5°
H21C33H22109.5°109.5°
H24C35H25109.5°109.5°
H26C36H27109.5°109.5°
H28C37H29109.5°109.5°
H30C38H31109.4°109.5°
H30C38H32109.5°109.4°
H31C38H32109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C38C37N34H28120.8°120.0°
C38C37N34H29120.8°120.1°
C38C37N34C35178.2°170.1°
C38C37N34C3352.1°66.2°
C38C37H28H29117.4°120.1°
C37C38H30H31120.0°120.0°
C37C38H30H32120.0°120.0°
C37C38H31H32120.0°120.0°
C37N34C35C33127.4°123.8°
C37N34C35C36177.7°176.8°
C37N34C33C32171.8°176.8°
C37N34C33H2151.4°56.9°
C37N34C33H2267.7°63.2°
C37N34C35H2461.4°56.9°
C37N34C35H2556.9°63.2°
N34C37H28H29117.3°119.9°
N34C37C38H30180.0°60.0°
N34C37C38H3160.0°180.0°
N34C37C38H3260.0°60.0°
N34C35C36H24120.9°119.9°
N34C35C36H25120.9°120.0°
N34C35C36N3154.0°58.4°
C35N34C33C3246.7°59.4°
C35N34C33H2173.7°179.3°
C35N34C33H22167.2°60.6°
N34C35H24H25117.3°120.0°
N34C35C36H2666.1°178.4°
N34C35C36H27174.1°61.5°
C35N34C37H2861.0°70.0°
C35N34C37H2957.3°50.0°
C33N34C35C3650.3°59.4°
N34C33C32H21120.5°120.0°
N34C33C32H22120.5°120.1°
N34C33C32N3149.3°58.4°
N34C33C32H19169.9°61.5°
N34C33C32H2071.3°178.4°
N34C33H21H22118.6°120.2°
C33N34C35H24171.2°179.3°
C33N34C35H2570.5°60.6°
C33N34C37H28173.0°53.8°
C33N34C37H2968.7°173.7°
C35C36N31H26120.1°120.0°
C35C36N31H27120.1°119.9°
C35C36N31C3253.8°59.3°
C35C36N31C30179.4°176.8°
C36C35H24H25117.2°120.1°
C35C36H26H27119.7°120.1°
F28C25F26F27116.9°120.0°
F28C25F26C24119.5°120.0°
F28C25F27C24120.1°120.0°
F28C25C24C2357.8°60.0°
F28C25C24C29120.2°120.3°
C36N31C32C3353.5°59.3°
C36N31C32C30126.3°123.9°
C36N31C30C2370.2°66.1°
C36N31C30H16169.5°53.8°
C36N31C30H1750.1°173.8°
C36N31C32H19174.2°60.6°
C36N31C32H2067.1°179.3°
N31C36C35H24174.9°178.3°
N31C36C35H2566.8°61.6°
N31C36H26H27119.6°120.1°
C33C32N31H19120.6°119.9°
C33C32N31H20120.6°120.0°
C33C32N31C30179.9°176.8°
C33C32H19H20118.1°120.0°
C32C33H21H22118.6°120.0°
C32N31C30C23163.5°170.0°
C32N31C30H1643.3°70.0°
C32N31C30H1776.2°49.9°
N31C32H19H20118.1°120.1°
N31C32C33H2171.2°178.4°
N31C32C33H22169.7°61.6°
C32N31C36H2666.3°179.3°
C32N31C36H27173.9°60.6°
F26C25F27C24121.7°120.0°
F26C25C24C23178.4°60.0°
F26C25C24C290.4°119.7°
F27C25C24C2362.3°180.0°
F27C25C24C29119.6°0.3°
C25C24C23C300.9°0.0°
C25C24C23C29178.0°179.7°
C25C24C23C22178.0°180.0°
C25C24C29C20175.9°179.7°
C25C24C29H154.1°0.3°
N31C30C23H16120.3°120.0°
N31C30C23H17120.3°120.1°
N31C30C23C24136.0°80.0°
N31C30C23C2242.9°100.0°
N31C30H16H17119.2°120.0°
C30N31C32H1959.5°63.3°
C30N31C32H2059.3°56.8°
C30N31C36H2659.3°56.8°
C30N31C36H2760.5°63.3°
C30C23C24C22178.9°180.0°
C30C23C24C29178.9°179.7°
C30C23C22C21178.4°180.0°
C30C23C22H141.6°0.0°
C23C30H16H17119.2°120.0°
C23C24C29C202.2°0.6°
C24C23C22C210.5°0.0°
C24C23C22H14179.5°180.0°
C23C24C29H15177.9°180.0°
C24C23C30H16103.7°160.0°
C24C23C30H1715.8°40.0°
C29C24C23C220.0°0.3°
C24C29C20H15180.0°179.4°
C24C29C20C213.8°0.6°
C24C29C20N19175.4°179.7°
C23C22C21H14180.0°180.0°
C23C22C21C201.1°0.0°
C23C22C21H13178.9°180.0°
C22C23C30H1677.4°20.0°
C22C23C30H17163.1°139.9°
C29C20C21C223.2°0.3°
C29C20C21N19172.0°179.7°
C29C20N19C1832.5°154.0°
C29C20N19H12147.5°26.0°
C29C20C21H13176.8°179.7°
O39C18N19C201.6°6.0°
O39C18N19C05176.3°179.9°
O39C18C05C069.1°0.0°
O39C18C05C04166.1°180.0°
O39C18N19H12178.4°174.0°
C22C21C20H13180.0°180.0°
C22C21C20N19175.2°180.0°
C15C16N17H10180.0°179.8°
C16C15C14H9180.0°180.0°
C15C16N17C130.5°0.3°
C16C15C14C130.8°0.0°
C16C15C14C09178.9°179.4°
C15C16N17H11179.5°180.0°
N17C16C15C140.8°0.2°
C16N17C13H11180.0°179.6°
C16N17C13C140.1°0.3°
C16N17C13N12178.9°179.9°
N17C16C15H9179.2°179.8°
C21C20N19C18155.7°26.3°
C21C20N19H1224.3°153.7°
C20C21C22H14178.9°180.0°
C21C20C29H15176.3°180.0°
C20N19C18H12180.0°180.0°
C20N19C18C05174.6°173.9°
N19C20C21H134.8°0.0°
N19C20C29H154.6°0.3°
C15C14C13N170.6°0.2°
C15C14C13C09178.5°179.5°
C15C14C13N12179.5°180.0°
C15C14C09O081.2°0.4°
C15C14C09C10178.8°179.8°
C14C15C16H10179.2°180.0°
N17C13C14N12178.9°179.8°
N17C13C14C09179.1°179.7°
N17C13N12C11178.5°180.0°
C13N17C16H10179.5°179.9°
N19C18C05C06174.5°180.0°
N19C18C05C0410.3°0.0°
C18C05C06C04175.2°180.0°
C18C05C06C07177.8°179.7°
C18C05C04C03178.1°180.0°
C18C05C04H52.0°0.0°
C18C05C06H62.2°0.0°
C05C18N19H125.4°6.1°
C13C14C09O08179.2°179.7°
C13C14C09C100.9°0.5°
C14C13N12C112.9°0.3°
C13C14C15H9179.2°180.0°
C14C13N17H11180.0°180.0°
C09C14C13N122.0°0.5°
C14C09O08C10179.9°179.8°
C14C09O08C07179.9°88.5°
C14C09C10C110.5°0.3°
C14C09C10H7179.5°179.8°
C09C14C15H91.1°0.7°
C13N12C11C102.5°0.0°
C13N12C11H8177.5°180.0°
N12C13N17H111.2°0.3°
C05C06C07H6180.0°179.7°
C05C06C07O08175.4°180.0°
C05C06C07C021.2°0.5°
C06C05C04C033.0°0.1°
C06C05C04H5177.0°180.0°
C06C07O08C0990.0°5.0°
C06C07O08C02176.6°179.5°
C07C06C05C042.6°0.3°
C06C07C02C030.3°0.6°
C06C07C02C01179.4°179.8°
C09O08C07C0293.4°174.5°
O08C09C10C11179.5°179.9°
O08C09C10H70.5°0.0°
C07O08C09C100.2°91.3°
O08C07C02C03176.3°179.9°
O08C07C02C012.8°0.3°
O08C07C06H64.7°0.3°
C09C10C11N121.4°0.0°
C09C10C11H7180.0°179.9°
C09C10C11H8178.6°180.0°
N12C11C10H8180.0°180.0°
N12C11C10H7178.6°180.0°
C05C04C03H5180.0°180.0°
C05C04C03C022.1°0.1°
C05C04C03H4177.9°180.0°
C04C05C06H6177.4°180.0°
C07C02C03C040.7°0.4°
C07C02C03C01179.1°179.7°
C07C02C01H189.6°90.3°
C07C02C01H2150.4°29.7°
C07C02C01H330.4°149.7°
C07C02C03H4179.2°179.8°
C02C07C06H6178.8°179.8°
C04C03C02H4180.0°179.9°
C04C03C02C01179.8°180.0°
C03C02C01H189.5°90.0°
C03C02C01H230.5°150.0°
C03C02C01H3150.5°29.9°
C02C03C04H5178.0°179.9°
C02C01H1H2120.0°120.0°
C02C01H1H3120.0°119.9°
C02C01H2H3120.0°120.0°
C01C02C03H40.2°0.1°
H1C01H2H3120.0°120.0°
H4C03C04H52.1°0.1°
H7C10C11H81.3°0.1°
H9C15C16H100.8°0.0°
H10C16N17H110.5°0.3°
H13C21C22H141.1°0.0°
H19C32C33H2149.4°58.4°
H19C32C33H2269.7°178.4°
H20C32C33H21168.2°61.6°
H20C32C33H2249.1°58.4°
H24C35C36H2654.8°61.7°
H24C35C36H2765.0°58.4°
H25C35C36H26173.1°58.4°
H25C35C36H2753.3°178.5°
H28C37C38H3059.1°60.0°
H28C37C38H3160.8°60.0°
H28C37C38H32179.2°180.0°
H29C37C38H3059.2°180.0°
H29C37C38H31179.2°60.0°
H29C37C38H3260.9°60.0°
H30C38H31H32120.0°120.0°

222415

PDB entries from 2024-07-10

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