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A1EEQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C06C07doub1.38Å1.39ÅAromatic
C06C05sing1.38Å1.39ÅAromatic
C07C08sing1.40Å1.38ÅAromatic
O10C09doub1.21Å1.26Å
CL27C26sing1.74Å1.77Å
C05C04doub1.39Å1.39ÅAromatic
C25C26doub1.38Å1.37ÅAromatic
C25C23sing1.38Å1.37ÅAromatic
CL24C23sing1.74Å1.77Å
C26C20sing1.39Å1.38ÅAromatic
C08C09sing1.48Å1.53Å
C08C12doub1.40Å1.37ÅAromatic
C23C22doub1.38Å1.38ÅAromatic
C09O11sing1.35Å1.25Å
C20N19sing1.40Å1.45Å
C20C21doub1.39Å1.39ÅAromatic
O28S02doub1.42Å1.47Å
C04C12sing1.39Å1.38ÅAromatic
C04N03sing1.40Å1.45Å
C22C21sing1.38Å1.39ÅAromatic
N19C18sing1.39Å1.46Å
N17C18doub1.32Å1.31ÅAromatic
N17C16sing1.32Å1.32ÅAromatic
C18C13sing1.39Å1.38ÅAromatic
C16C15doub1.38Å1.39ÅAromatic
C13S02sing1.76Å1.81Å
C13C14doub1.38Å1.38ÅAromatic
C15C14sing1.39Å1.39ÅAromatic
S02N03sing1.66Å1.70Å
S02O01doub1.42Å1.48Å
C15H1sing1.08Å1.08Å
C21H2sing1.08Å1.08Å
C22H3sing1.08Å1.08Å
C05H4sing1.08Å1.08Å
C06H5sing1.08Å1.08Å
C07H6sing1.08Å1.08Å
C12H7sing1.08Å1.08Å
C14H8sing1.08Å1.08Å
C16H9sing1.08Å1.08Å
C25H10sing1.08Å1.08Å
N03H11sing0.97Å1.00Å
N19H12sing0.97Å1.00Å
O11H13sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C07C06C05120.9°120.2°
C06C07C08119.0°120.1°
C07C06H5119.6°119.9°
C06C07H6120.5°119.9°
C06C05C04119.4°120.2°
C06C05H4120.3°119.9°
C05C06H5119.5°119.9°
C07C08C09120.8°120.2°
C07C08C12120.0°119.7°
C08C07H6120.5°120.0°
O10C09C08120.6°120.0°
O10C09O11119.7°120.0°
CL27C26C25119.0°120.1°
CL27C26C20119.8°120.0°
C05C04C12119.3°120.0°
C05C04N03124.2°120.0°
C04C05H4120.3°119.9°
C26C25C23119.2°120.1°
C25C26C20121.1°119.9°
C26C25H10120.4°120.0°
C25C23CL24117.6°119.9°
C25C23C22121.3°120.1°
C23C25H10120.4°120.0°
CL24C23C22121.2°119.9°
C26C20N19117.7°120.1°
C26C20C21119.3°119.8°
C09C08C12119.1°120.1°
C08C09O11119.7°120.0°
C08C12C04121.3°119.8°
C08C12H7119.3°120.1°
C23C22C21119.0°120.1°
C23C22H3120.5°120.0°
C09O11H13109.5°117.0°
N19C20C21123.0°120.1°
C20N19C18125.2°120.0°
C20N19H12117.4°120.0°
C20C21C22120.1°119.9°
C20C21H2120.0°120.0°
O28S02C13110.9°106.4°
O28S02N03110.8°106.4°
O28S02O01103.9°123.1°
C12C04N03116.4°120.0°
C04C12H7119.4°120.1°
C04N03S02122.6°120.0°
C04N03H11106.1°120.0°
C22C21H2120.0°120.0°
C21C22H3120.5°119.9°
N19C18N17121.0°119.7°
N19C18C13119.4°119.7°
C18N19H12117.4°120.0°
C18N17C16122.5°121.6°
N17C18C13119.6°120.5°
N17C16C15120.4°120.8°
N17C16H9119.8°119.6°
C18C13S02119.6°120.4°
C18C13C14120.5°119.1°
C16C15C14119.4°119.4°
C16C15H1120.3°120.3°
C15C16H9119.8°119.6°
S02C13C14119.9°120.5°
C13S02N03109.4°107.2°
C13S02O01107.3°106.4°
C13C14C15117.6°118.5°
C13C14H8121.2°120.7°
C14C15H1120.3°120.3°
C15C14H8121.2°120.8°
N03S02O01114.4°106.4°
S02N03H11106.1°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C07C06C05H5180.0°179.9°
C06C07C08H6180.0°180.0°
C07C06C05C041.1°0.1°
C06C07C08C09179.5°179.9°
C06C07C08C120.4°0.0°
C07C06C05H4178.9°180.0°
C05C06C07C080.6°0.0°
C06C05C04H4180.0°180.0°
C06C05C04C121.3°0.0°
C06C05C04N03179.7°179.7°
C05C06C07H6179.3°179.9°
C07C08C09O103.4°180.0°
C07C08C09C12179.1°179.9°
C07C08C09O11175.8°0.0°
C07C08C12C040.7°0.1°
C08C07C06H5179.3°180.0°
C07C08C12H7179.4°179.7°
O10C09C08O11179.2°180.0°
O10C09C08C12177.4°0.1°
O10C09O11H130.0°0.0°
CL27C26C25C20178.7°179.9°
CL27C26C25C23179.2°180.0°
CL27C26C20N191.5°0.0°
CL27C26C20C21180.0°179.7°
CL27C26C25H100.8°0.1°
C05C04C12C081.1°0.0°
C05C04C12N03179.1°179.7°
C05C04N03S026.9°46.6°
C04C05C06H5178.9°180.0°
C05C04C12H7178.9°179.7°
C05C04N03H11128.6°133.5°
C26C25C23H10180.0°179.9°
C26C25C23CL24179.8°179.9°
C26C25C23C220.7°0.3°
C25C26C20N19179.8°180.0°
C25C26C20C211.2°0.2°
C25C23CL24C22179.4°179.7°
C23C25C26C200.4°0.1°
C25C23C22C211.1°0.3°
C25C23C22H3179.0°179.7°
CL24C23C22C21179.5°180.0°
CL24C23C22H30.5°0.0°
CL24C23C25H100.2°0.0°
C26C20N19C21178.5°179.7°
C26C20C21C220.9°0.3°
C26C20N19C18156.5°150.1°
C26C20C21H2179.1°179.8°
C20C26C25H10179.6°180.0°
C26C20N19H1223.6°29.9°
C09C08C12C04179.8°180.0°
C09C08C07H60.5°0.1°
C09C08C12H70.2°0.2°
C08C09O11H13179.2°180.0°
C12C08C09O113.3°180.0°
C08C12C04H7180.0°179.8°
C08C12C04N03179.8°179.8°
C12C08C07H6179.6°180.0°
C23C22C21C200.2°0.0°
C23C22C21H3180.0°180.0°
C23C22C21H2179.8°179.9°
C22C23C25H10179.3°179.7°
N19C20C21C22179.4°180.0°
C20N19C18H12180.0°180.0°
C20N19C18N177.9°4.8°
C20N19C18C13173.3°175.1°
N19C20C21H20.6°0.1°
C20C21C22H2180.0°180.0°
C21C20N19C1825.1°30.2°
C20C21C22H3179.8°180.0°
C21C20N19H12154.9°149.8°
O28S02N03C0435.6°178.4°
O28S02C13C1844.5°47.4°
O28S02C13N03122.5°113.5°
O28S02C13O01112.9°132.9°
O28S02C13C14136.8°132.8°
O28S02N03O01117.1°132.9°
O28S02N03H1186.2°1.6°
C12C04N03S02172.1°133.2°
C12C04C05H4178.7°180.0°
C12C04N03H1150.4°46.8°
C04N03S02C1386.9°64.9°
C04N03S02H11121.8°180.0°
C04N03S02O01152.7°48.7°
N03C04C05H40.3°0.3°
N03C04C12H70.1°0.0°
N19C18N17C13178.8°180.0°
N19C18N17C16179.7°180.0°
N19C18C13S021.0°0.0°
N19C18C13C14179.7°179.7°
C18N17C16C150.9°0.3°
N17C18C13S02179.9°180.0°
N17C18C13C141.4°0.2°
C18N17C16H9179.2°179.9°
N17C18N19H12172.1°175.2°
C16N17C18C131.5°0.0°
N17C16C15H9180.0°179.8°
N17C16C15C140.1°0.3°
N17C16C15H1179.9°179.7°
C18C13S02C14178.7°179.7°
C18C13C14C150.7°0.3°
C18C13S02N03167.0°66.1°
C18C13S02O0168.4°179.6°
C18C13C14H8179.3°179.7°
C13C18N19H126.7°4.9°
C16C15C14C130.1°0.0°
C16C15C14H1180.0°180.0°
C16C15C14H8180.0°180.0°
S02C13C14C15179.4°180.0°
C13S02N03O01120.4°113.6°
S02C13C14H80.6°0.0°
C13S02N03H11151.3°115.2°
C13C14C15H8180.0°180.0°
C14C13S02N0314.3°113.6°
C14C13S02O01110.3°0.1°
C13C14C15H1179.9°180.0°
C14C15C16H9179.9°180.0°
O01S02N03H1130.9°131.3°
H1C15C14H80.1°0.0°
H1C15C16H90.1°0.0°
H2C21C22H30.2°0.0°
H4C05C06H51.1°0.0°
H5C06C07H60.7°0.0°

249697

PDB entries from 2026-02-25

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