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4KE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O09C07doub1.21Å1.21Å
O08C07sing1.35Å1.24Å
C07C06sing1.47Å1.44Å
C06C01sing1.50Å1.48Å
C06C05doub1.32Å1.46Å
C01C02sing1.53Å1.45Å
C05C04sing1.50Å1.54Å
C02O12sing1.43Å1.34Å
C02C03sing1.53Å1.55Å
O12C13sing1.35Å1.28Å
C04C03sing1.53Å1.45Å
C04O10sing1.43Å1.35Å
C03O11sing1.43Å1.43Å
C13C14sing1.42Å1.50Å
C13O17doub1.22Å1.30Å
C14C15doub1.35Å1.31Å
C22C21doub1.38Å1.39ÅAromatic
C22C16sing1.40Å1.39ÅAromatic
C21C20sing1.39Å1.40ÅAromatic
C15C16sing1.47Å1.52Å
C16C18doub1.40Å1.40ÅAromatic
C20O23sing1.36Å1.43Å
C20C19doub1.39Å1.39ÅAromatic
C18C19sing1.38Å1.40ÅAromatic
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C02H3sing1.09Å1.10Å
C03H4sing1.09Å1.10Å
C04H5sing1.09Å1.10Å
C05H6sing1.08Å1.08Å
O08H7sing0.97Å0.95Å
O10H8sing0.97Å0.95Å
O11H9sing0.97Å0.95Å
C14H10sing1.08Å1.08Å
C15H11sing1.08Å1.08Å
C18H12sing1.08Å1.08Å
C19H13sing1.08Å1.08Å
C21H14sing1.08Å1.08Å
C22H15sing1.08Å1.08Å
O23H16sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O09C07O08120.9°120.0°
O09C07C06120.5°120.0°
O08C07C06117.4°120.0°
C07O08H7109.5°117.0°
C07C06C01121.9°118.1°
C07C06C05118.0°118.1°
C01C06C05120.0°123.8°
C06C01C02115.7°110.1°
C06C01H1107.9°109.3°
C06C01H2107.9°109.3°
C06C05C04116.2°123.8°
C06C05H6121.9°118.1°
C01C02O12113.4°109.6°
C01C02C03115.9°108.5°
C02C01H1107.9°109.4°
C02C01H2107.9°109.4°
C01C02H3105.4°109.6°
C05C04C03117.7°110.1°
C05C04O10106.7°109.4°
C05C04H5108.5°109.2°
C04C05H6121.9°118.1°
O12C02C03110.1°109.6°
C02O12C13118.4°117.0°
O12C02H3106.7°109.7°
C02C03C04117.0°108.5°
C02C03O11111.8°109.6°
C03C02H3104.4°109.8°
C02C03H4105.1°109.6°
O12C13C14118.1°120.0°
O12C13O17119.8°120.0°
C03C04O10103.0°109.4°
C04C03O11109.5°109.6°
C04C03H4106.2°109.8°
C03C04H5109.6°109.3°
O10C04H5111.2°109.4°
C04O10H8109.5°114.0°
O11C03H4106.5°109.7°
C03O11H9109.5°113.9°
C14C13O17120.9°120.0°
C13C14C15121.3°120.0°
C13C14H10119.4°120.0°
C14C15C16120.8°120.0°
C15C14H10119.3°120.0°
C14C15H11119.6°120.0°
C21C22C16119.7°119.9°
C22C21C20120.6°120.2°
C22C21H14119.7°119.9°
C21C22H15120.1°120.1°
C22C16C15120.5°120.1°
C22C16C18119.9°119.8°
C16C22H15120.2°120.0°
C21C20O23120.4°119.9°
C21C20C19119.8°120.2°
C20C21H14119.7°119.9°
C15C16C18119.6°120.1°
C16C15H11119.6°120.0°
C16C18C19120.2°119.9°
C16C18H12119.9°120.0°
O23C20C19119.8°119.9°
C20O23H16109.5°114.0°
C20C19C18119.7°120.1°
C20C19H13120.1°119.9°
C19C18H12119.9°120.1°
C18C19H13120.2°120.0°
H1C01H2109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O09C07O08C06167.8°179.9°
O09C07C06C0127.3°179.9°
O09C07C06C05151.4°0.1°
O09C07O08H70.0°0.1°
O08C07C06C01164.9°0.0°
O08C07C06C0516.4°180.0°
C07C06C01C05178.7°180.0°
C07C06C01C02153.6°162.9°
C07C06C05C04169.0°179.6°
C07C06C01H132.6°76.9°
C07C06C01H285.5°42.7°
C07C06C05H611.0°0.4°
C06C07O08H7167.8°180.0°
C06C01C02H1120.9°120.2°
C06C01C02H2120.9°120.1°
C01C06C05C0412.3°0.4°
C06C01C02O12172.0°169.4°
C06C01C02C0343.3°49.8°
C06C01H1H2117.2°119.6°
C06C01C02H371.6°70.2°
C01C06C05H6167.7°179.6°
C05C06C01C0225.1°17.1°
C06C05C04H6180.0°180.0°
C06C05C04C0331.7°17.2°
C06C05C04O10146.6°103.0°
C05C06C01H1146.0°103.1°
C05C06C01H295.8°137.3°
C06C05C04H593.5°137.3°
C01C02O12C03131.7°119.0°
C01C02O12H3115.6°120.4°
C01C02C03H3115.5°119.8°
C01C02O12C13147.7°90.0°
C01C02C03C0423.8°68.1°
C01C02C03O11103.7°51.6°
C02C01H1H2117.2°119.7°
C01C02C03H4141.3°172.0°
C05C04C03C0213.5°49.8°
C05C04C03O10117.0°120.2°
C05C04C03H5124.6°120.0°
C05C04O10H5118.1°119.6°
C05C04C03O11142.1°69.9°
C05C04C03H4103.3°169.6°
C05C04O10H8180.0°59.4°
O12C02C03H3114.1°120.5°
O12C02C03C04154.2°172.2°
O12C02C03O1126.8°68.1°
C02O12C13C14178.2°179.9°
C02O12C13O1710.6°0.0°
O12C02C01H167.0°49.3°
O12C02C01H251.1°70.5°
O12C02C03H488.3°52.4°
C03C02O12C1380.6°151.0°
C02C03C04O11128.6°119.7°
C02C03C04H4116.9°119.8°
C02C03C04O10130.5°70.4°
C02C03O11H4114.2°120.4°
C03C02C01H1164.2°70.4°
C03C02C01H277.6°169.8°
C02C03C04H5111.0°169.8°
C02C03O11H9180.0°179.9°
O12C13C14O17167.4°179.9°
O12C13C14C15173.8°180.0°
C13O12C02H332.1°30.4°
O12C13C14H106.2°0.1°
C03C04O10H5117.3°119.7°
C04C03O11H4114.4°120.6°
C04C03C02H391.6°51.7°
C03C04C05H6148.3°162.8°
C03C04O10H855.4°180.0°
C04C03O11H948.6°61.0°
O10C04C03O11100.9°169.9°
O10C04C03H413.6°49.4°
O10C04C05H633.4°77.0°
O11C03C02H3140.9°171.4°
O11C03C04H517.5°50.1°
C13C14C15H10180.0°179.9°
C13C14C15C16164.8°179.9°
C13C14C15H1115.2°0.0°
O17C13C14C156.4°0.1°
O17C13C14H10173.6°180.0°
C14C15C16C2224.0°0.2°
C14C15C16H11180.0°179.9°
C14C15C16C18156.4°180.0°
C21C22C16H15180.0°179.5°
C22C21C20H14180.0°179.8°
C21C22C16C15179.8°179.7°
C21C22C16C180.3°0.5°
C22C21C20O23179.5°179.8°
C22C21C20C190.0°0.2°
C16C22C21C200.1°0.5°
C22C16C15C18179.6°179.8°
C22C16C18C190.3°0.3°
C22C16C15H11156.0°179.7°
C22C16C18H12179.7°179.8°
C16C22C21H14179.9°179.7°
C21C20O23C19179.4°180.0°
C21C20C19C180.0°0.0°
C21C20C19H13179.9°180.0°
C20C21C22H15179.9°180.0°
C21C20O23H16180.0°90.0°
C15C16C18C19179.9°180.0°
C16C15C14H1015.2°0.0°
C15C16C18H120.1°0.0°
C15C16C22H150.1°0.2°
C16C18C19C200.2°0.0°
C16C18C19H12180.0°180.0°
C18C16C15H1123.6°0.1°
C16C18C19H13179.8°180.0°
C18C16C22H15179.7°180.0°
O23C20C19C18179.4°180.0°
O23C20C19H130.6°0.0°
O23C20C21H140.5°0.0°
C20C19C18H13180.0°180.0°
C20C19C18H12179.8°180.0°
C19C20C21H14180.0°180.0°
C19C20O23H160.5°90.0°
H1C01C02H349.3°169.7°
H2C01C02H3167.5°49.9°
H3C02C03H425.8°68.2°
H4C03C04H5132.1°70.4°
H4C03O11H965.7°59.6°
H5C04C05H686.5°42.8°
H5C04O10H861.9°60.2°
H10C14C15H11164.8°179.9°
H12C18C19H130.2°0.0°
H14C21C22H150.1°0.2°

226262

PDB entries from 2024-10-16

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