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SummaryGeometryRelated PDB entries

MQJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C23C24doub1.36Å1.42ÅAromatic
C23C22sing1.39Å1.38ÅAromatic
C24C03sing1.41Å1.41ÅAromatic
C22C21doub1.36Å1.40ÅAromatic
C03C04doub1.41Å1.42ÅAromatic
C03C02sing1.42Å1.42ÅAromatic
C21C02sing1.41Å1.40ÅAromatic
C04C05sing1.36Å1.37ÅAromatic
C02C01doub1.40Å1.42ÅAromatic
C05C06doub1.39Å1.39ÅAromatic
C01C06sing1.36Å1.41ÅAromatic
C06S07sing1.76Å1.83Å
F20C13sing1.35Å1.38Å
C12C13doub1.38Å1.40ÅAromatic
C12C16sing1.38Å1.39ÅAromatic
C13C11sing1.40Å1.47ÅAromatic
O17S07doub1.42Å1.46Å
S07O18doub1.42Å1.48Å
S07N08sing1.66Å1.80Å
C16C15doub1.38Å1.45ÅAromatic
N09N08sing1.40Å1.42Å
N09C10sing1.35Å1.41Å
C11C10sing1.48Å1.44Å
C11C14doub1.40Å1.41ÅAromatic
C10O19doub1.22Å1.26Å
C15C14sing1.38Å1.41ÅAromatic
C12H1sing1.08Å1.08Å
C14H2sing1.08Å1.08Å
C15H3sing1.08Å1.08Å
C16H4sing1.08Å1.08Å
C21H5sing1.08Å1.08Å
C22H6sing1.08Å1.08Å
N09H7sing0.97Å1.00Å
N08H8sing0.97Å1.00Å
C01H9sing1.08Å1.08Å
C23H10sing1.08Å1.08Å
C24H11sing1.08Å1.08Å
C04H12sing1.08Å1.08Å
C05H13sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C24C23C22123.5°121.0°
C23C24C03116.4°119.7°
C24C23H10118.2°119.5°
C23C24H11121.8°120.2°
C23C22C21119.8°121.0°
C23C22H6120.1°119.5°
C22C23H10118.2°119.6°
C24C03C04118.0°121.3°
C24C03C02119.8°119.3°
C03C24H11121.8°120.1°
C22C21C02117.9°119.7°
C22C21H5121.0°120.2°
C21C22H6120.1°119.5°
C04C03C02122.3°119.3°
C03C04C05117.1°119.7°
C03C04H12121.4°120.1°
C03C02C21122.3°119.3°
C03C02C01120.3°119.4°
C21C02C01117.2°121.3°
C02C21H5121.1°120.1°
C04C05C06120.8°121.0°
C05C04H12121.4°120.2°
C04C05H13119.6°119.5°
C02C01C06115.1°119.6°
C02C01H9122.5°120.2°
C05C06C01124.3°121.0°
C05C06S07116.2°119.5°
C06C05H13119.6°119.5°
C01C06S07119.5°119.5°
C06C01H9122.5°120.2°
C06S07O17101.6°106.4°
C06S07O18106.6°106.4°
C06S07N08109.5°107.2°
F20C13C12113.1°120.1°
F20C13C11120.3°120.1°
C13C12C16115.6°120.1°
C12C13C11126.5°119.8°
C13C12H1122.2°119.9°
C12C16C15119.5°120.3°
C16C12H1122.2°119.9°
C12C16H4120.3°119.9°
C13C11C10124.4°120.2°
C13C11C14116.9°119.7°
O17S07O18114.7°123.1°
O17S07N08115.8°106.4°
O18S07N08108.0°106.4°
S07N08N09115.1°120.0°
S07N08H8108.0°120.0°
C16C15C14125.0°120.2°
C16C15H3117.5°119.9°
C15C16H4120.3°119.8°
N08N09C10121.3°120.0°
N08N09H7119.3°120.0°
N09N08H8108.1°120.0°
N09C10C11112.7°120.0°
N09C10O19121.4°120.0°
C10N09H7119.3°120.0°
C10C11C14118.8°120.2°
C11C10O19125.9°120.0°
C11C14C15116.5°119.9°
C11C14H2121.7°120.1°
C15C14H2121.8°120.0°
C14C15H3117.5°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C24C23C22H10180.0°179.7°
C23C24C03H11180.0°179.8°
C24C23C22C212.2°0.0°
C23C24C03C04179.6°179.9°
C23C24C03C021.2°0.5°
C24C23C22H6177.8°179.9°
C22C23C24C031.5°0.2°
C23C22C21H6180.0°179.9°
C23C22C21C025.9°0.0°
C23C22C21H5174.1°179.7°
C22C23C24H11178.5°180.0°
C24C03C04C02179.1°179.5°
C24C03C02C212.6°0.5°
C24C03C04C05179.7°179.9°
C24C03C02C01177.2°179.5°
C03C24C23H10178.6°180.0°
C24C03C04H120.3°0.1°
C22C21C02C036.2°0.3°
C22C21C02H5180.0°179.7°
C22C21C02C01179.0°179.8°
C21C22C23H10177.8°179.7°
C04C03C02C21176.5°180.0°
C03C04C05H12180.0°179.8°
C04C03C02C011.9°0.1°
C03C04C05C062.2°0.1°
C04C03C24H110.4°0.3°
C03C04C05H13177.8°180.0°
C03C02C21C01174.8°180.0°
C02C03C04C050.5°0.6°
C03C02C01C062.4°1.0°
C03C02C21H5173.8°180.0°
C03C02C01H9177.6°179.0°
C02C03C24H11178.7°179.8°
C02C03C04H12179.5°179.5°
C21C02C01C06177.3°179.0°
C02C21C22H6174.1°180.0°
C21C02C01H92.7°1.0°
C04C05C06H13180.0°179.8°
C04C05C06C011.7°1.0°
C04C05C06S07177.2°179.5°
C02C01C06C050.7°1.5°
C02C01C06H9180.0°180.0°
C02C01C06S07179.6°180.0°
C01C02C21H51.0°0.1°
C05C06C01S07178.9°178.5°
C05C06S07O1763.3°155.0°
C05C06S07O18176.3°22.1°
C05C06S07N0859.7°91.5°
C05C06C01H9179.3°178.5°
C06C05C04H12177.8°180.0°
C01C06S07O17115.7°23.5°
C01C06S07O184.7°156.4°
C01C06S07N08121.3°90.0°
C01C06C05H13178.3°178.9°
C06S07O17O18114.5°123.0°
C06S07O17N08118.5°114.1°
C06S07O18N08117.6°114.1°
C06S07N08N0982.6°60.0°
C06S07N08H8156.6°120.0°
S07C06C01H90.4°0.0°
S07C06C05H132.7°0.4°
F20C13C12C11178.7°179.9°
F20C13C12C16178.7°180.0°
F20C13C11C101.6°0.1°
F20C13C11C14177.9°179.8°
F20C13C12H11.3°0.1°
C13C12C16H1180.0°180.0°
C13C12C16C150.7°0.2°
C12C13C11C10179.8°180.0°
C12C13C11C140.6°0.3°
C13C12C16H4179.3°180.0°
C16C12C13C110.0°0.0°
C12C16C15H4180.0°179.8°
C12C16C15C140.7°0.2°
C12C16C15H3179.3°179.7°
C13C11C10N0941.5°180.0°
C13C11C10C14179.5°179.6°
C13C11C10O19139.1°0.3°
C13C11C14C150.6°0.3°
C11C13C12H1180.0°180.0°
C13C11C14H2179.4°179.7°
O17S07O18N08130.9°122.9°
O17S07N08N0931.5°173.5°
O17S07N08H889.4°6.4°
O18S07N08N09161.7°53.6°
O18S07N08H840.9°126.5°
S07N08N09H8120.8°180.0°
S07N08N09C1093.8°125.0°
S07N08N09H786.2°55.0°
C16C15C14C110.0°0.1°
C16C15C14H3180.0°179.9°
C15C16C12H1179.3°179.8°
C16C15C14H2180.0°180.0°
N08N09C10H7180.0°180.0°
N08N09C10C11176.9°179.7°
N08N09C10O192.5°0.1°
N09C10C11O19179.4°179.7°
N09C10C11C14139.0°0.3°
C10N09N08H827.0°55.0°
C10C11C14C15179.8°180.0°
C10C11C14H20.1°0.1°
C11C10N09H73.1°0.3°
C14C11C10O1940.4°180.0°
C11C14C15H2180.0°180.0°
C11C14C15H3180.0°180.0°
O19C10N09H7177.5°180.0°
C14C15C16H4179.3°180.0°
H1C12C16H40.7°0.0°
H2C14C15H30.0°0.0°
H3C15C16H40.7°0.1°
H5C21C22H65.9°0.3°
H6C22C23H102.2°0.3°
H7N09N08H8153.0°125.0°
H10C23C24H111.5°0.3°
H12C04C05H132.2°0.2°

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PDB entries from 2024-07-17

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