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W2T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CL3C32sing1.80Å1.79Å
C01C02doub1.38Å1.39ÅAromatic
C01C06sing1.38Å1.39ÅAromatic
C02C03sing1.39Å1.38ÅAromatic
C02F34sing1.35Å1.36Å
C03C04doub1.38Å1.38ÅAromatic
C04C05sing1.38Å1.38ÅAromatic
C05C06doub1.38Å1.39ÅAromatic
C05C07sing1.51Å1.53Å
C07N08sing1.47Å1.45Å
C07C12sing1.53Å1.53Å
N08C09sing1.35Å1.45Å
C09C10sing1.48Å1.53Å
C09O11doub1.22Å1.19Å
C10C13doub1.40Å1.45ÅAromatic
C10C17sing1.40Å1.42ÅAromatic
C13C14sing1.38Å1.41ÅAromatic
C14C15doub1.39Å1.35ÅAromatic
C15C16sing1.40Å1.53ÅAromatic
C15N18sing1.39Å1.44Å
C16C17doub1.39Å1.36ÅAromatic
C16C20sing1.48Å1.37Å
N18C19sing1.34Å1.33Å
C19C20sing1.47Å1.35Å
C19O21doub1.22Å1.40Å
C20C22doub1.38Å1.20Å
C22C23sing1.41Å1.53Å
C23N24sing1.38Å1.35ÅAromatic
C23C27doub1.39Å1.38ÅAromatic
N24C25sing1.36Å1.36ÅAromatic
C25C26doub1.36Å1.37ÅAromatic
C25C29sing1.51Å1.53Å
C26C27sing1.40Å1.34ÅAromatic
C26N30sing1.41Å1.46Å
C27C28sing1.51Å1.53Å
N30C31sing1.35Å1.45Å
C31C32sing1.51Å1.52Å
C31O33doub1.21Å1.19Å
C13H131sing1.08Å1.08Å
C17H171sing1.08Å1.08Å
C22H221sing1.08Å1.08Å
C28H282sing1.09Å1.10Å
C28H283sing1.09Å1.10Å
C28H281sing1.09Å1.10Å
C01H011sing1.08Å1.08Å
C03H031sing1.08Å1.08Å
C04H041sing1.08Å1.08Å
C06H061sing1.08Å1.08Å
C07H071sing1.09Å1.10Å
C12H123sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C14H141sing1.08Å1.08Å
C29H292sing1.09Å1.10Å
C29H293sing1.09Å1.10Å
C29H291sing1.09Å1.10Å
C32H322sing1.09Å1.10Å
C32H321sing1.09Å1.10Å
N08H081sing0.97Å1.00Å
N18H181sing0.97Å1.00Å
N24H241sing0.97Å1.00Å
N30H301sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CL3C32C31109.3°109.5°
CL3C32H322109.5°109.5°
CL3C32H321109.5°109.5°
C02C01C06120.0°120.0°
C01C02C03120.1°119.9°
C01C02F34120.2°120.1°
C02C01H011120.0°120.0°
C01C06C05119.7°120.0°
C06C01H011120.0°120.0°
C01C06H061120.1°120.0°
C03C02F34119.8°120.0°
C02C03C04120.0°119.9°
C02C03H031120.0°120.0°
C03C04C05120.2°120.1°
C04C03H031120.0°120.1°
C03C04H041119.9°120.0°
C04C05C06120.0°120.0°
C04C05C07118.9°120.0°
C05C04H041119.9°120.0°
C06C05C07121.1°120.0°
C05C06H061120.2°120.0°
C05C07N08109.0°109.4°
C05C07C12110.7°109.5°
C05C07H071108.7°109.5°
N08C07C12109.9°109.5°
C07N08C09119.5°120.0°
N08C07H071109.8°109.5°
C07N08H081120.2°120.0°
C12C07H071108.7°109.5°
C07C12H123109.5°109.4°
C07C12H122109.4°109.5°
C07C12H121109.5°109.5°
N08C09C10120.1°120.0°
N08C09O11120.1°120.0°
C09N08H081120.3°120.0°
C10C09O11119.9°120.0°
C09C10C13119.2°120.1°
C09C10C17120.6°120.1°
C13C10C17120.3°119.7°
C10C13C14120.2°120.5°
C10C13H131119.9°119.7°
C10C17C16120.0°119.6°
C10C17H171120.0°120.2°
C13C14C15120.2°120.3°
C14C13H131119.9°119.8°
C13C14H141119.9°119.8°
C14C15C16120.0°119.3°
C14C15N18136.6°131.6°
C15C14H141119.9°119.9°
C16C15N18103.4°109.1°
C15C16C17119.4°120.5°
C15C16C20100.4°106.3°
C15N18C19113.4°111.5°
C15N18H181123.3°124.2°
C17C16C20140.2°133.2°
C16C17H171120.0°120.2°
C16C20C19118.9°105.0°
C16C20C22118.6°127.5°
N18C19C20103.9°108.1°
N18C19O21124.6°126.0°
C19N18H181123.3°124.3°
C20C19O21131.5°126.0°
C19C20C22122.5°127.5°
C20C22C23121.5°120.0°
C20C22H221119.3°120.0°
C22C23N24129.1°126.2°
C22C23C27122.9°126.2°
C23C22H221119.3°120.0°
N24C23C27108.0°107.5°
C23N24C25107.8°108.7°
C23N24H241126.1°125.7°
C23C27C26108.1°107.1°
C23C27C28126.2°126.5°
N24C25C26108.2°108.9°
N24C25C29127.1°125.6°
C25N24H241126.1°125.6°
C26C25C29124.7°125.6°
C25C26C27107.8°107.8°
C25C26N30125.9°126.1°
C25C29H292109.5°109.4°
C25C29H293109.5°109.4°
C25C29H291109.5°109.5°
C27C26N30126.3°126.0°
C26C27C28125.7°126.5°
C26N30C31120.9°120.0°
C26N30H301119.6°120.0°
C27C28H282109.5°109.5°
C27C28H283109.5°109.5°
C27C28H281109.5°109.5°
N30C31C32119.2°120.0°
N30C31O33120.2°120.0°
C31N30H301119.6°120.0°
C32C31O33120.5°120.0°
C31C32H322109.5°109.5°
C31C32H321109.5°109.5°
H282C28H283109.4°109.5°
H282C28H281109.5°109.5°
H283C28H281109.5°109.5°
H123C12H122109.5°109.5°
H123C12H121109.5°109.5°
H122C12H121109.5°109.5°
H292C29H293109.5°109.5°
H292C29H291109.4°109.5°
H293C29H291109.5°109.5°
H322C32H321109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CL3C32C31N30130.2°180.0°
CL3C32C31H322120.0°120.0°
CL3C32C31H321120.0°120.1°
CL3C32C31O3349.9°0.0°
CL3C32H322H321120.1°120.0°
C02C01C06H011180.0°179.7°
C01C02C03F34179.7°179.9°
C01C02C03C040.2°0.1°
C02C01C06C050.2°0.0°
C01C02C03H031179.9°180.0°
C02C01C06H061179.7°180.0°
C06C01C02C030.2°0.0°
C06C01C02F34179.8°180.0°
C01C06C05C040.3°0.0°
C01C06C05H061180.0°180.0°
C01C06C05C07179.8°180.0°
C02C03C04H031180.0°180.0°
C02C03C04C050.2°0.1°
C03C02C01H011179.9°179.7°
C02C03C04H041179.7°180.0°
F34C02C03C04179.8°180.0°
F34C02C01H0110.2°0.3°
F34C02C03H0310.2°0.0°
C03C04C05H041180.0°179.9°
C03C04C05C060.3°0.0°
C03C04C05C07179.8°180.0°
C04C05C06C07179.5°180.0°
C04C05C07N08144.6°140.0°
C04C05C07C1294.4°100.0°
C05C04C03H031179.8°180.0°
C04C05C06H061179.7°180.0°
C04C05C07H07124.9°20.0°
C06C05C07N0834.9°40.0°
C06C05C07C1286.1°80.0°
C05C06C01H011179.8°179.7°
C06C05C04H041179.7°180.0°
C06C05C07H071154.5°159.9°
C05C07N08C12121.5°120.0°
C05C07N08H071119.0°120.0°
C05C07C12H071119.3°120.0°
C05C07N08C09121.7°155.0°
C07C05C04H0410.2°0.0°
C07C05C06H0610.2°0.0°
C05C07C12H123180.0°179.9°
C05C07C12H12260.0°60.0°
C05C07C12H12160.0°60.0°
C05C07N08H08158.3°25.0°
N08C07C12H071120.2°120.0°
C07N08C09H081180.0°180.0°
C07N08C09C10179.7°180.0°
C07N08C09O110.7°0.0°
N08C07C12H12359.5°60.0°
N08C07C12H122179.5°180.0°
N08C07C12H12160.5°60.0°
C12C07N08C09116.8°85.0°
C07C12H123H122120.0°120.0°
C07C12H123H121120.0°120.0°
C07C12H122H121120.0°120.0°
C12C07N08H08163.2°95.0°
N08C09C10O11179.0°180.0°
N08C09C10C13180.0°0.0°
N08C09C10C170.4°179.8°
C09N08C07H0712.7°35.0°
C09C10C13C17179.6°179.8°
C09C10C13C14179.8°179.8°
C09C10C17C16180.0°179.7°
C09C10C13H1310.2°0.3°
C09C10C17H1710.0°0.2°
C10C09N08H0810.3°0.0°
O11C09C10C131.1°180.0°
O11C09C10C17178.6°0.2°
O11C09N08H081179.3°180.0°
C10C13C14H131180.0°179.9°
C10C13C14C150.1°0.1°
C13C10C17C160.4°0.0°
C13C10C17H171179.6°180.0°
C10C13C14H141179.9°180.0°
C17C10C13C140.2°0.0°
C10C17C16C150.3°0.1°
C10C17C16H171180.0°179.9°
C10C17C16C20179.7°180.0°
C17C10C13H131179.8°179.9°
C13C14C15H141180.0°179.9°
C13C14C15C160.2°0.0°
C13C14C15N18179.8°180.0°
C14C15C16N18180.0°180.0°
C14C15C16C170.0°0.0°
C14C15C16C20180.0°180.0°
C14C15N18C19180.0°179.9°
C15C14C13H131179.9°180.0°
C14C15N18H1810.1°0.1°
C15C16C17C20180.0°179.9°
C16C15N18C190.0°0.1°
C15C16C20C190.0°0.0°
C15C16C20C22179.6°180.0°
C15C16C17H171179.7°180.0°
C16C15C14H141179.9°180.0°
C16C15N18H181180.0°179.9°
N18C15C16C17180.0°180.0°
N18C15C16C200.0°0.0°
C15N18C19H181180.0°179.8°
C15N18C19C200.0°0.2°
C15N18C19O21180.0°180.0°
N18C15C14H1410.2°0.0°
C17C16C20C19180.0°179.9°
C17C16C20C220.4°0.1°
C16C20C19N180.1°0.1°
C16C20C19C22179.6°179.9°
C16C20C19O21180.0°179.9°
C16C20C22C23178.5°172.3°
C20C16C17H1710.3°0.1°
C16C20C22H2211.5°7.7°
N18C19C20O21180.0°179.8°
N18C19C20C22179.5°179.9°
C19C20C22C231.9°7.8°
C19C20C22H221178.1°172.3°
C20C19N18H181180.0°179.9°
O21C19C20C220.4°0.1°
O21C19N18H1810.0°0.3°
C20C22C23H221180.0°179.9°
C20C22C23N2483.9°30.8°
C20C22C23C2793.8°148.7°
C22C23N24C27178.0°179.5°
C22C23N24C25179.0°179.9°
C22C23C27C26179.2°179.9°
C22C23C27C281.3°0.1°
C22C23N24H2411.0°0.5°
C23N24C25H241180.0°179.6°
C23N24C25C260.7°0.2°
C23N24C25C29179.5°179.7°
N24C23C27C261.1°0.4°
N24C23C27C28179.4°179.6°
N24C23C22H22196.1°149.2°
C27C23N24C251.1°0.4°
C23C27C26C250.7°0.2°
C23C27C26C28179.5°180.0°
C23C27C26N30179.9°180.0°
C27C23C22H22186.2°31.4°
C23C27C28H28289.7°83.1°
C23C27C28H283150.3°36.9°
C23C27C28H28130.3°156.9°
C27C23N24H241178.9°180.0°
N24C25C26C29179.8°180.0°
N24C25C26C270.0°0.0°
N24C25C26N30179.5°179.8°
N24C25C29H29289.9°85.1°
N24C25C29H293150.1°34.9°
N24C25C29H29130.1°154.9°
C25C26C27N30179.5°179.8°
C25C26C27C28179.8°179.7°
C25C26N30C3175.9°130.7°
C26C25C29H29289.9°94.9°
C26C25C29H29330.1°145.1°
C26C25C29H291150.1°25.0°
C26C25N24H241179.3°179.9°
C25C26N30H301104.1°49.2°
C29C25C26C27179.8°180.0°
C29C25C26N300.4°0.3°
C25C29H292H293120.0°120.0°
C25C29H292H291120.0°120.0°
C25C29H293H291120.0°120.0°
C29C25N24H2410.5°0.1°
C27C26N30C31104.7°49.6°
C26C27C28H28289.7°96.9°
C26C27C28H28330.3°143.1°
C26C27C28H281150.3°23.1°
C27C26N30H30175.3°130.5°
N30C26C27C280.3°0.0°
C26N30C31H301180.0°179.9°
C26N30C31C32179.6°175.9°
C26N30C31O330.5°4.2°
C27C28H282H283120.0°120.0°
C27C28H282H281120.0°120.0°
C27C28H283H281120.0°120.0°
N30C31C32O33179.9°180.0°
N30C31C32H322109.8°60.0°
N30C31C32H32110.2°60.0°
C31C32H322H321120.1°120.0°
C32C31N30H3010.4°4.1°
O33C31C32H32270.1°120.0°
O33C31C32H321169.9°120.1°
O33C31N30H301179.5°175.9°
H131C13C14H1410.1°0.1°
H282C28H283H281120.0°120.0°
H011C01C06H0610.2°0.3°
H031C03C04H0410.2°0.0°
H071C07C12H12360.7°60.0°
H071C07C12H12259.3°60.0°
H071C07C12H121179.3°NaN°
H071C07N08H081177.3°145.0°
H123C12H122H121120.0°120.0°
H292C29H293H291119.9°120.1°

223532

PDB entries from 2024-08-07

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