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SummaryGeometryRelated PDB entries

40Q

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O4C12doub1.21Å1.24Å
C12C13sing1.47Å1.51Å
C26C13doub1.40Å1.37ÅAromatic
C26C25sing1.37Å1.38ÅAromatic
C13C14sing1.40Å1.38ÅAromatic
C25C16doub1.39Å1.38ÅAromatic
C17N3sing1.47Å1.47Å
C17C18sing1.53Å1.53Å
C14C15doub1.37Å1.38ÅAromatic
C16C15sing1.39Å1.38ÅAromatic
C16N3sing1.39Å1.37Å
C18N8sing1.47Å1.47Å
C18C19sing1.54Å1.51Å
N8C21sing1.41Å1.40Å
C19N4sing1.47Å1.45Å
O5C22doub1.22Å1.27Å
C21C22sing1.40Å1.49Å
C21C20doub1.39Å1.45Å
N4C20sing1.39Å1.33Å
C22N5sing1.35Å1.33Å
C20N7sing1.34Å1.33Å
N5C23sing1.36Å1.35Å
N7C23doub1.32Å1.36Å
C23N6sing1.37Å1.37Å
N6H1sing0.97Å1.00Å
N6H2sing0.97Å1.00Å
N8H4sing0.97Å1.00Å
C18H6sing1.09Å1.10Å
C19H7sing1.09Å1.10Å
C19H8sing1.09Å1.10Å
N4H9sing0.97Å1.00Å
C17H10sing1.09Å1.10Å
C17H11sing1.09Å1.10Å
N3H12sing0.97Å1.00Å
C26H13sing1.08Å1.08Å
C25H14sing1.08Å1.08Å
C15H15sing1.08Å1.08Å
C14H16sing1.08Å1.08Å
C12OXTsing1.35Å53.48Å
OXTHXTsing0.97Å0.00Å
N5H17sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O4C12C13117.6°120.0°
O4C12OXT159.4°120.0°
C12C13C26118.4°120.1°
C12C13C14124.1°120.0°
C13C12OXT43.1°120.0°
C13C26C25121.2°119.9°
C26C13C14117.5°119.9°
C13C26H13119.4°120.0°
C26C25C16121.7°120.1°
C25C26H13119.4°120.0°
C26C25H14119.1°120.0°
C13C14C15121.0°119.9°
C13C14H16119.5°120.1°
C25C16C15117.0°120.1°
C25C16N3123.1°120.0°
C16C25H14119.1°119.9°
N3C17C18114.9°109.5°
C17N3C16126.4°120.0°
N3C17H10108.1°109.4°
N3C17H11108.1°109.5°
C17N3H12105.1°120.0°
C17C18N8115.8°109.7°
C17C18C19112.9°109.7°
C17C18H6106.2°109.8°
C18C17H10108.1°109.4°
C18C17H11108.1°109.5°
C14C15C16121.5°120.1°
C14C15H15119.2°120.0°
C15C14H16119.5°120.0°
C15C16N3119.9°119.9°
C16C15H15119.2°120.0°
C16N3H12105.1°120.0°
N8C18C19108.0°108.1°
C18N8C21113.8°118.5°
C18N8H4108.4°120.7°
N8C18H6106.8°109.7°
C18C19N4111.4°108.4°
C19C18H6106.4°109.8°
C18C19H7109.0°109.7°
C18C19H8109.0°109.7°
N8C21C22123.9°120.8°
N8C21C20119.0°120.2°
C21N8H4108.4°120.8°
C19N4C20122.3°119.1°
N4C19H7109.0°109.7°
N4C19H8109.0°109.7°
C19N4H9106.2°120.4°
O5C22C21123.3°120.8°
O5C22N5119.5°120.7°
C22C21C20117.1°119.1°
C21C22N5117.2°118.5°
C21C20N4119.2°119.8°
C21C20N7120.2°119.6°
N4C20N7120.5°120.5°
C20N4H9106.2°120.5°
C22N5C23122.3°120.2°
C22N5H17118.8°120.0°
C20N7C23120.1°121.0°
N5C23N7123.1°121.6°
N5C23N6118.4°119.2°
C23N5H17118.9°119.8°
N7C23N6118.5°119.2°
C23N6H1120.0°120.0°
C23N6H2120.0°119.9°
H1N6H2120.0°120.0°
H7C19H8109.5°109.7°
H10C17H11109.5°109.5°
C12OXTHXT90.0°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O4C12C13OXT170.9°179.9°
O4C12C13C262.4°179.7°
O4C12C13C14179.1°0.0°
O4C12OXTHXT90.0°0.1°
C12C13C26C14178.6°179.7°
C12C13C26C25179.6°179.7°
C12C13C14C15179.3°179.7°
C12C13C26H130.3°0.3°
C12C13C14H160.7°0.2°
C13C12OXTHXT90.0°180.0°
C13C26C25H13180.0°180.0°
C13C26C25C161.4°0.0°
C26C13C14C150.8°0.0°
C13C26C25H14178.7°180.0°
C26C13C14H16179.2°180.0°
C26C13C12OXT173.4°0.3°
C25C26C13C141.8°0.0°
C26C25C16H14180.0°180.0°
C26C25C16C150.1°0.0°
C26C25C16N3178.1°180.0°
C13C14C15H16180.0°179.9°
C13C14C15C160.7°0.0°
C14C13C26H13178.2°180.0°
C13C14C15H15179.4°180.0°
C14C13C12OXT8.2°180.0°
C25C16N3C177.8°180.0°
C25C16C15C141.1°0.0°
C25C16C15N3178.0°180.0°
C25C16N3H12114.4°0.0°
C16C25C26H13178.7°180.0°
C25C16C15H15178.9°180.0°
N3C17C18H10120.8°120.0°
N3C17C18H11120.8°120.0°
C17N3C16C15170.1°0.0°
C17N3C16H12122.2°180.0°
N3C17C18N850.6°55.0°
N3C17C18C1974.7°173.6°
N3C17C18H6169.0°65.7°
N3C17H10H11117.5°120.0°
C18C17N3C16106.6°180.0°
C17C18N8C19127.8°119.6°
C17C18N8H6118.1°120.7°
C17C18C19H6116.1°120.7°
C17C18N8C2171.9°75.6°
C17C18C19N476.3°63.4°
C17C18N8H448.7°104.5°
C17C18C19H7163.4°177.0°
C17C18C19H844.0°56.4°
C18C17H10H11117.5°120.0°
C18C17N3H1215.6°0.0°
C14C15C16H15180.0°180.0°
C14C15C16N3179.1°180.0°
C15C16N3H1267.7°180.0°
C15C16C25H14179.9°180.0°
C16C15C14H16179.3°180.0°
C16N3C17H1014.2°60.0°
C16N3C17H11132.6°60.0°
N3C16C25H141.9°0.0°
N3C16C15H150.9°0.0°
N8C18C19H6114.4°119.7°
C18N8C21H4120.6°179.9°
N8C18C19N453.1°56.3°
C18N8C21C22150.4°164.2°
C18N8C21C2030.8°15.9°
N8C18C19H767.2°63.4°
N8C18C19H8173.4°176.1°
N8C18C17H1070.2°65.0°
N8C18C17H11171.3°175.0°
C19C18N8C2155.9°44.0°
C18C19N4H7120.3°119.7°
C18C19N4H8120.3°119.8°
C18C19N4C2027.0°45.6°
C19C18N8H4176.5°135.9°
C18C19H7H8119.1°120.6°
C18C19N4H9148.7°134.3°
C19C18C17H10164.5°53.7°
C19C18C17H1146.0°66.4°
N8C21C22O50.1°0.2°
N8C21C22C20178.9°179.9°
N8C21C20N41.2°0.3°
N8C21C22N5178.7°179.8°
N8C21C20N7179.4°179.7°
C21N8C18H6170.0°163.7°
C19N4C20C210.1°17.2°
C19N4C20H9121.8°179.9°
C19N4C20N7179.4°162.7°
N4C19C18H6167.6°176.0°
N4C19H7H8119.1°120.5°
O5C22C21N5178.6°180.0°
O5C22C21C20178.8°179.9°
O5C22N5C23179.2°179.9°
O5C22N5H170.7°0.1°
C22C21C20N4179.9°179.8°
C22C21C20N70.4°0.2°
C21C22N5C230.6°0.1°
C22C21N8H429.7°15.9°
C21C22N5H17179.4°179.9°
C21C20N4N7179.5°180.0°
C20C21C22N50.2°0.1°
C21C20N7C230.6°0.2°
C20C21N8H4151.4°164.0°
C21C20N4H9121.7°162.7°
N4C20N7C23180.0°179.9°
C20N4C19H793.3°74.1°
C20N4C19H8147.3°165.4°
C22N5C23H17180.0°180.0°
C22N5C23N70.4°0.2°
C22N5C23N6179.7°179.9°
C20N7C23N50.2°0.0°
C20N7C23N6179.7°180.0°
N7C20N4H958.9°17.3°
N5C23N7N6179.9°179.9°
N5C23N6H1179.9°180.0°
N5C23N6H20.1°0.0°
N7C23N6H10.0°0.0°
N7C23N6H2180.0°180.0°
N7C23N5H17179.5°179.8°
C23N6H1H2180.0°180.0°
N6C23N5H170.4°0.1°
H4N8C18H669.4°16.2°
H6C18C19H747.2°56.3°
H6C18C19H872.1°64.3°
H6C18C17H1048.2°174.3°
H6C18C17H1170.2°54.3°
H7C19N4H928.4°106.0°
H8C19N4H991.0°14.5°
H10C17N3H12136.4°119.9°
H11C17N3H12105.1°120.0°
H13C26C25H141.3°0.0°
H15C15C14H160.7°0.1°

222415

PDB entries from 2024-07-10

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