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SummaryGeometryRelated PDB entries

XUZ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C02F01sing1.35Å1.33Å
C03C02doub1.38Å1.40ÅAromatic
C04C03sing1.38Å1.39ÅAromatic
C05C04doub1.38Å1.39ÅAromatic
CL06C05sing1.74Å1.77Å
C07C05sing1.38Å1.40ÅAromatic
C08C07doub1.38Å1.41ÅAromatic
C09C07sing1.51Å1.55Å
N10C09sing1.47Å1.49Å
C11N10sing1.34Å1.41Å
O12C11doub1.22Å1.22Å
C13C11sing1.48Å1.53Å
C14C13doub1.39Å1.40ÅAromatic
C15C14sing1.39Å1.43ÅAromatic
C17C16sing1.39Å1.43ÅAromatic
C19N18sing1.35Å1.43Å
O20C19doub1.22Å1.22Å
C21C19sing1.48Å1.57Å
C22C21doub1.40Å1.40ÅAromatic
C23C22sing1.38Å1.41ÅAromatic
F24C23sing1.35Å1.33Å
C25C23doub1.38Å1.41ÅAromatic
C26C25sing1.38Å1.39ÅAromatic
C27C26doub1.38Å1.40ÅAromatic
C28C26sing1.51Å1.55Å
F29C28sing1.40Å1.34Å
F30C28sing1.40Å1.34Å
F31C28sing1.40Å1.34Å
N18C17sing1.40Å1.46Å
C32C17doub1.38Å1.40ÅAromatic
C16C15doub1.39Å1.41ÅAromatic
C33C15sing1.48Å1.53Å
C34C33sing1.41Å1.45ÅAromatic
C35C34doub1.36Å1.37ÅAromatic
C36C35sing1.41Å1.43ÅAromatic
N37C36doub1.33Å1.37ÅAromatic
C38N37sing1.32Å1.40ÅAromatic
N39C38doub1.31Å1.38ÅAromatic
N40N39sing1.40Å1.39ÅAromatic
C41N40sing1.37Å1.43ÅAromatic
C42C41sing1.43Å1.44Å
N43C42trip1.14Å1.16Å
C02C08sing1.38Å1.41ÅAromatic
C09C32sing1.51Å1.56Å
C13C32sing1.40Å1.41ÅAromatic
C21C27sing1.40Å1.40ÅAromatic
C33C41doub1.39Å1.40ÅAromatic
C36N40sing1.37Å1.42ÅAromatic
C22H221sing1.08Å1.08Å
C03H031sing1.08Å1.08Å
C04H041sing1.08Å1.08Å
C08H081sing1.08Å1.08Å
C09H091sing1.09Å1.10Å
C14H141sing1.08Å1.08Å
C16H161sing1.08Å1.08Å
C25H251sing1.08Å1.08Å
C27H271sing1.08Å1.08Å
C34H341sing1.08Å1.08Å
C35H351sing1.08Å1.08Å
C38H381sing1.08Å1.08Å
N10H101sing0.97Å1.00Å
N18H181sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
F01C02C03119.0°120.0°
F01C02C08121.8°120.0°
C02C03C04119.2°120.0°
C03C02C08119.2°119.9°
C02C03H031120.4°120.0°
C03C04C05120.9°120.0°
C04C03H031120.4°120.0°
C03C04H041119.6°120.0°
C04C05CL06118.0°120.0°
C04C05C07121.6°120.0°
C05C04H041119.6°120.0°
CL06C05C07120.4°120.0°
C05C07C08117.0°120.0°
C05C07C09120.4°120.0°
C08C07C09122.5°120.0°
C07C08C02122.1°120.0°
C07C08H081119.0°120.0°
C07C09N10118.4°110.1°
C07C09C32112.2°110.1°
C07C09H091107.5°110.1°
C09N10C11111.9°108.8°
N10C09C32102.8°106.3°
N10C09H091108.1°110.1°
C09N10H101124.1°125.6°
N10C11O12121.8°124.8°
N10C11C13107.8°110.3°
C11N10H101124.0°125.7°
O12C11C13130.3°124.9°
C11C13C14132.6°132.2°
C11C13C32107.4°108.2°
C13C14C15121.4°119.9°
C14C13C32120.0°119.6°
C13C14H141119.3°120.0°
C14C15C16117.2°120.1°
C14C15C33121.0°119.9°
C15C14H141119.3°120.1°
C16C17N18123.1°120.0°
C16C17C32118.3°120.0°
C17C16C15122.6°120.0°
C17C16H161118.7°120.0°
N18C19O20117.9°120.0°
N18C19C21121.8°120.0°
C19N18C17128.3°120.0°
C19N18H181115.9°120.0°
O20C19C21120.2°120.0°
C19C21C22122.6°120.1°
C19C21C27120.3°120.1°
C21C22C23121.4°119.8°
C22C21C27117.1°119.8°
C21C22H221119.3°120.1°
C22C23F24119.9°119.9°
C22C23C25120.4°120.1°
C23C22H221119.3°120.1°
F24C23C25119.7°120.0°
C23C25C26118.5°120.3°
C23C25H251120.7°119.9°
C25C26C27120.6°120.1°
C25C26C28119.7°119.9°
C26C25H251120.8°119.8°
C27C26C28119.6°119.9°
C26C27C21122.0°119.9°
C26C27H271119.0°120.0°
C26C28F29113.9°109.4°
C26C28F30113.2°109.4°
C26C28F31113.3°109.5°
F29C28F30105.1°109.5°
F29C28F31105.5°109.5°
F30C28F31104.8°109.5°
N18C17C32118.7°120.0°
C17N18H181115.9°120.0°
C17C32C09129.4°133.1°
C17C32C13120.6°120.5°
C16C15C33121.8°120.0°
C15C16H161118.7°120.0°
C15C33C34119.1°120.1°
C15C33C41123.1°120.2°
C33C34C35122.4°119.7°
C34C33C41117.8°119.7°
C33C34H341118.8°120.2°
C34C35C36120.4°119.9°
C35C34H341118.8°120.1°
C34C35H351119.8°120.1°
C35C36N37132.5°132.5°
C35C36N40118.0°120.1°
C36C35H351119.8°120.0°
C36N37C38104.3°109.7°
N37C36N40109.5°107.4°
N37C38N39113.3°109.6°
N37C38H381123.4°125.2°
C38N39N40104.5°107.0°
N39C38H381123.4°125.2°
N39N40C41130.4°133.1°
N39N40C36108.5°106.3°
N40C41C42117.5°120.0°
N40C41C33120.2°120.0°
C41N40C36121.2°120.6°
C41C42N43179.7°179.9°
C42C41C33122.3°120.1°
C02C08H081119.0°120.0°
C09C32C13110.0°106.4°
C32C09H091107.2°110.1°
C21C27H271119.0°120.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
F01C02C03C08179.9°179.6°
F01C02C03C04180.0°180.0°
F01C02C08C07179.3°179.8°
F01C02C03H0310.0°0.1°
F01C02C08H0810.7°0.0°
C02C03C04H031180.0°180.0°
C02C03C04C050.0°0.0°
C03C02C08C070.8°0.6°
C02C03C04H041180.0°179.9°
C03C02C08H081179.2°179.7°
C03C04C05H041180.0°179.9°
C03C04C05CL06180.0°179.9°
C03C04C05C070.6°0.0°
C04C03C02C080.1°0.3°
C04C05CL06C07179.3°180.0°
C04C05C07C081.3°0.3°
C04C05C07C09179.3°180.0°
C05C04C03H031180.0°180.0°
CL06C05C07C08179.4°179.8°
CL06C05C07C091.3°0.1°
CL06C05C04H0410.1°0.0°
C05C07C08C09178.0°179.7°
C05C07C09N1096.1°141.3°
C05C07C08C021.4°0.6°
C05C07C09C32144.3°101.9°
C07C05C04H041179.4°180.0°
C05C07C08H081178.6°179.7°
C05C07C09H09126.6°19.7°
C08C07C09N1085.9°39.0°
C07C08C02H081180.0°179.7°
C08C07C09C3233.6°77.9°
C08C07C09H091151.3°160.6°
C07C09N10C32124.3°119.2°
C07C09N10H091122.5°121.6°
C07C09N10C11126.9°119.2°
C07C09C32C1751.0°60.8°
C09C07C08C02179.4°179.7°
C07C09C32H091117.8°121.6°
C07C09C32C13130.4°119.2°
C09C07C08H0810.6°0.0°
C07C09N10H10153.1°60.8°
C09N10C11H101180.0°180.0°
C09N10C11O12178.7°180.0°
C09N10C11C132.1°0.0°
N10C09C32C17179.4°180.0°
N10C09C32H091113.9°119.3°
N10C09C32C132.1°0.0°
N10C11O12C13179.0°180.0°
N10C11C13C14179.5°179.7°
C11N10C09C322.5°0.0°
N10C11C13C320.6°0.0°
C11N10C09H091110.7°119.2°
O12C11C13C140.4°0.3°
O12C11C13C32179.8°180.0°
O12C11N10H1011.3°0.0°
C11C13C14C32179.8°179.7°
C11C13C14C15179.8°179.9°
C11C13C32C17179.7°180.0°
C11C13C32C091.0°0.0°
C11C13C14H1410.2°0.0°
C13C11N10H101177.9°180.0°
C13C14C15H141180.0°179.9°
C14C13C32C170.2°0.2°
C13C14C15C160.1°0.0°
C13C14C15C33179.8°180.0°
C14C13C32C09178.9°179.8°
C14C15C16C170.4°0.3°
C14C15C16C33179.7°179.9°
C14C15C33C3449.0°64.8°
C15C14C13C320.0°0.2°
C14C15C33C41131.7°115.0°
C14C15C16H161179.6°180.0°
C16C17N18C19126.5°28.5°
C16C17N18C32178.6°179.8°
C17C16C15H161180.0°179.7°
C17C16C15C33179.9°179.8°
C16C17C32C09178.9°180.0°
C16C17C32C130.5°0.0°
C16C17N18H18153.5°151.4°
N18C19O20C21180.0°180.0°
N18C19C21C2213.8°5.6°
C19N18C17H181180.0°179.9°
C19N18C17C3254.9°151.3°
N18C19C21C27166.7°174.1°
O20C19C21C22166.2°174.5°
O20C19N18C172.2°4.2°
O20C19C21C2713.3°5.9°
O20C19N18H181177.8°175.7°
C19C21C22C27179.5°179.7°
C19C21C22C23179.8°180.0°
C19C21C27C26179.7°179.7°
C21C19N18C17177.9°175.7°
C19C21C22H2210.3°0.0°
C19C21C27H2710.3°0.0°
C21C19N18H1812.2°4.3°
C21C22C23H221180.0°180.0°
C21C22C23F24179.8°180.0°
C21C22C23C250.2°0.0°
C22C21C27C260.2°0.6°
C22C21C27H271179.8°179.7°
C22C23F24C25180.0°180.0°
C22C23C25C260.0°0.0°
C23C22C21C270.3°0.3°
C22C23C25H251180.0°179.7°
F24C23C25C26179.9°180.0°
F24C23C22H2210.2°0.0°
F24C23C25H2510.0°0.2°
C23C25C26H251180.0°179.8°
C23C25C26C270.0°0.2°
C23C25C26C28179.9°180.0°
C25C23C22H221179.8°180.0°
C25C26C27C28179.9°179.7°
C25C26C28F2974.4°0.0°
C25C26C28F3045.7°120.0°
C25C26C28F31164.9°120.0°
C25C26C27C210.1°0.5°
C25C26C27H271179.9°179.7°
C27C26C28F29105.5°179.7°
C27C26C28F30134.4°60.3°
C27C26C28F3115.2°59.7°
C26C27C21H271180.0°179.7°
C27C26C25H251180.0°180.0°
C26C28F29F30124.5°120.0°
C26C28F29F31125.0°120.0°
C26C28F30F31124.0°120.0°
C28C26C27C21180.0°179.7°
C28C26C25H2510.2°0.3°
C28C26C27H2710.0°0.0°
F29C28F30F31111.0°120.0°
N18C17C16C15179.2°180.0°
N18C17C32C092.4°0.2°
N18C17C32C13179.2°179.8°
N18C17C16H1610.8°0.2°
C32C17C16C150.6°0.3°
C17C32C09C13178.5°180.0°
C17C32C09H09166.8°60.7°
C32C17C16H161179.4°180.0°
C32C17N18H181125.1°28.8°
C16C15C33C34130.7°115.3°
C16C15C33C4148.6°65.0°
C16C15C14H141179.8°179.9°
C15C33C34C41179.4°179.7°
C15C33C34C35180.0°180.0°
C15C33C41N40179.7°179.7°
C15C33C41C420.6°0.1°
C33C15C14H1410.1°0.1°
C33C15C16H1610.1°0.1°
C15C33C34H3410.0°0.0°
C33C34C35H341180.0°179.9°
C33C34C35C360.7°0.0°
C34C33C41N400.4°0.6°
C34C33C41C42179.9°179.7°
C33C34C35H351179.4°180.0°
C34C35C36H351180.0°180.0°
C34C35C36N37179.9°180.0°
C35C34C33C410.6°0.3°
C34C35C36N400.4°0.1°
C35C36N37N40179.7°180.0°
C35C36N37C38179.7°180.0°
C35C36N40N39179.8°180.0°
C35C36N40C410.2°0.3°
C36C35C34H341179.3°180.0°
C36N37C38N390.0°0.0°
N37C36N40N390.0°0.0°
N37C36N40C41180.0°179.7°
N37C36C35H3510.1°0.0°
C36N37C38H381180.0°179.9°
N37C38N39H381180.0°180.0°
N37C38N39N400.0°0.0°
C38N37C36N400.0°0.0°
C38N39N40C41180.0°179.6°
C38N39N40C360.0°0.0°
N39N40C41C36180.0°179.6°
N39N40C41C420.1°0.1°
N39N40C41C33179.8°179.8°
N40N39C38H381180.0°180.0°
N40C41C42C33179.7°179.8°
N40C41C42N43150.4°111.6°
C42C41N40C36179.9°179.7°
N43C42C41C3329.9°68.2°
C08C02C03H031179.9°179.7°
C32C09N10H101177.4°180.0°
C13C32C09H091111.8°119.3°
C32C13C14H141179.9°179.7°
C27C21C22H221179.8°179.7°
C33C41N40C360.2°0.6°
C41C33C34H341179.4°179.8°
N40C36C35H351179.6°180.0°
H031C03C04H0410.0°0.0°
H091C09N10H10169.4°60.8°
H341C34C35H3510.7°0.1°

225946

PDB entries from 2024-10-09

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