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SummaryGeometryRelated PDB entries

POJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C21C22sing1.55Å1.55Å
C21N18sing1.47Å1.51Å
C25N26sing1.47Å1.49Å
C25C24sing1.53Å1.55Å
C27C28sing1.53Å1.54Å
C27N26sing1.47Å1.48Å
C22C23sing1.55Å1.52Å
N18C24sing1.47Å1.53Å
N18S17sing1.66Å1.74Å
C28O29sing1.43Å1.41Å
N26C31sing1.47Å1.49Å
O29C30sing1.43Å1.41Å
O20S17doub1.42Å1.43Å
C24C23sing1.54Å1.57Å
C31C30sing1.53Å1.54Å
S17O19doub1.42Å1.43Å
S17C14sing1.76Å1.76Å
C14C15doub1.38Å1.40ÅAromatic
C14C13sing1.38Å1.40ÅAromatic
C15C16sing1.38Å1.40ÅAromatic
C13C12doub1.38Å1.40ÅAromatic
C16C11doub1.39Å1.43ÅAromatic
C12C11sing1.39Å1.41ÅAromatic
C11N09sing1.40Å1.45Å
O10C08doub1.22Å1.21Å
N09C08sing1.35Å1.44Å
C08N07sing1.35Å1.44Å
N07C05sing1.40Å1.47Å
C04C05doub1.39Å1.43ÅAromatic
C04C03sing1.38Å1.41ÅAromatic
C05C06sing1.39Å1.41ÅAromatic
C03C02doub1.38Å1.41ÅAromatic
C06C01doub1.38Å1.41ÅAromatic
C02C01sing1.38Å1.39ÅAromatic
C02C32sing1.51Å1.54Å
F35C32sing1.40Å1.34Å
C32F33sing1.40Å1.34Å
C32F34sing1.40Å1.35Å
C12H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C01H3sing1.08Å1.08Å
C03H4sing1.08Å1.08Å
C04H5sing1.08Å1.08Å
C06H6sing1.08Å1.08Å
C15H7sing1.08Å1.08Å
C16H8sing1.08Å1.08Å
C21H9sing1.09Å1.10Å
C21H10sing1.09Å1.10Å
C22H11sing1.09Å1.10Å
C22H12sing1.09Å1.10Å
C23H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C24H15sing1.09Å1.10Å
C25H16sing1.09Å1.10Å
C25H17sing1.09Å1.10Å
C27H18sing1.09Å1.10Å
C27H19sing1.09Å1.10Å
C28H20sing1.09Å1.10Å
C28H21sing1.09Å1.10Å
C30H22sing1.09Å1.10Å
C30H23sing1.09Å1.10Å
C31H24sing1.09Å1.10Å
C31H25sing1.09Å1.10Å
N07H26sing0.97Å1.00Å
N09H27sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C22C21N18112.4°104.8°
C21C22C23104.2°101.6°
C22C21H9108.8°110.4°
C22C21H10108.7°110.4°
C21C22H11110.8°111.0°
C21C22H12110.8°111.0°
C21N18C24100.8°108.7°
C21N18S17128.0°125.7°
N18C21H9108.7°110.3°
N18C21H10108.7°110.4°
N26C25C24107.5°109.5°
C25N26C27109.0°111.0°
C25N26C31110.0°111.0°
N26C25H16110.0°109.4°
N26C25H17109.9°109.5°
C25C24N18113.4°110.0°
C25C24C23111.0°109.9°
C25C24H15108.1°109.9°
C24C25H16110.0°109.5°
C24C25H17110.0°109.5°
C28C27N26113.3°109.3°
C27C28O29112.9°109.2°
C28C27H18108.5°109.5°
C28C27H19108.5°109.5°
C27C28H20108.6°109.5°
C27C28H21108.6°109.5°
C27N26C31113.2°110.8°
N26C27H18108.5°109.5°
N26C27H19108.5°109.5°
C22C23C24106.0°102.9°
C23C22H11110.8°111.0°
C23C22H12110.8°111.0°
C22C23H13110.3°110.7°
C22C23H14110.3°110.7°
C24N18S17121.1°125.6°
N18C24C23108.2°107.2°
N18C24H15108.3°109.9°
N18S17O20112.5°106.4°
N18S17O19111.5°106.4°
N18S17C14103.6°107.2°
C28O29C30115.2°113.8°
O29C28H20108.6°109.5°
O29C28H21108.6°109.4°
N26C31C30114.5°109.2°
N26C31H24108.2°109.5°
N26C31H25108.2°109.5°
O29C30C31112.5°109.2°
O29C30H22108.7°109.5°
O29C30H23108.7°109.6°
O20S17O19109.0°123.2°
O20S17C14111.0°106.4°
C24C23H13110.3°110.8°
C24C23H14110.3°110.9°
C23C24H15107.8°109.8°
C31C30H22108.7°109.5°
C31C30H23108.7°109.5°
C30C31H24108.2°109.5°
C30C31H25108.2°109.5°
O19S17C14109.2°106.4°
S17C14C15121.6°119.9°
S17C14C13122.3°120.0°
C15C14C13116.1°120.1°
C14C15C16122.2°120.1°
C14C15H7118.9°120.0°
C14C13C12122.8°120.1°
C14C13H2118.6°119.9°
C15C16C11121.6°119.9°
C16C15H7118.9°119.9°
C15C16H8119.2°120.1°
C13C12C11121.2°119.9°
C13C12H1119.4°120.1°
C12C13H2118.6°120.0°
C16C11C12116.0°119.8°
C16C11N09121.5°120.1°
C11C16H8119.2°120.0°
C12C11N09122.4°120.1°
C11C12H1119.4°120.0°
C11N09C08128.3°120.0°
C11N09H27115.9°120.0°
O10C08N09119.5°120.0°
O10C08N07119.8°120.0°
N09C08N07120.7°120.1°
C08N09H27115.9°120.0°
C08N07C05130.3°120.0°
C08N07H26114.9°119.9°
N07C05C04124.8°120.1°
N07C05C06120.4°120.1°
C05N07H26114.9°120.0°
C05C04C03121.9°120.0°
C04C05C06114.8°119.8°
C05C04H5119.1°120.0°
C04C03C02121.3°120.1°
C04C03H4119.3°120.0°
C03C04H5119.0°120.1°
C05C06C01123.6°119.9°
C05C06H6118.2°120.0°
C03C02C01117.8°120.1°
C03C02C32122.5°119.9°
C02C03H4119.4°119.9°
C06C01C02120.6°120.1°
C06C01H3119.7°119.9°
C01C06H6118.2°120.1°
C01C02C32119.7°119.9°
C02C01H3119.7°120.0°
C02C32F35114.7°109.5°
C02C32F33113.4°109.5°
C02C32F34116.2°109.5°
F35C32F33103.6°109.4°
F35C32F34103.6°109.5°
F33C32F34103.8°109.4°
H9C21H10109.5°110.4°
H11C22H12109.5°110.9°
H13C23H14109.5°110.6°
H16C25H17109.5°109.5°
H18C27H19109.4°109.5°
H20C28H21109.4°109.6°
H22C30H23109.5°109.5°
H24C31H25109.4°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C22C21N18H9120.5°118.8°
C22C21N18H10120.4°118.9°
C21C22C23H11119.2°118.1°
C21C22C23H12119.2°118.1°
C22C21N18C2425.0°24.1°
C22C21N18S17119.8°155.9°
C21C22C23C247.4°35.5°
C22C21H9H10118.6°122.3°
C21C22H11H12122.4°123.9°
C21C22C23H13112.0°153.9°
C21C22C23H14126.9°83.0°
C21N18C24C2594.7°118.4°
N18C21C22C2311.3°37.0°
C21N18C24S17147.9°180.0°
C21N18S17O2045.9°152.0°
C21N18C24C2328.9°1.1°
C21N18S17O19168.8°19.0°
C21N18S17C1473.9°94.5°
N18C21H9H10118.6°122.3°
N18C21C22H11107.9°81.1°
N18C21C22H12130.4°155.1°
C21N18C24H15145.4°120.4°
N26C25C24H16119.7°120.0°
N26C25C24H17119.7°120.0°
C25N26C27C28166.1°177.6°
C25N26C27C31122.8°123.8°
N26C25C24N18137.9°172.2°
N26C25C24C23100.1°69.9°
C25N26C31C30164.8°177.6°
N26C25C24H1517.8°51.1°
N26C25H16H17120.9°120.0°
C25N26C27H1873.3°57.6°
C25N26C27H1945.6°62.5°
C25N26C31H2474.5°62.5°
C25N26C31H2544.1°57.7°
C24C25N26C27144.5°161.4°
C25C24C23C22101.4°141.8°
C25C24N18C23123.6°119.5°
C25C24N18H15119.9°121.2°
C25C24N18S17117.4°61.5°
C24C25N26C3190.8°74.9°
C25C24C23H15118.1°121.0°
C25C24C23H13139.1°99.9°
C25C24C23H1418.0°23.3°
C24C25H16H17120.9°120.0°
C28C27N26H18120.6°119.9°
C28C27N26H19120.6°120.0°
C27C28O29H20120.5°119.9°
C27C28O29H21120.5°119.9°
C28C27N26C3143.3°58.6°
C27C28O29C3054.0°58.7°
C28C27H18H19118.2°120.1°
C27C28H20H21118.4°120.2°
N26C27C28O2948.7°56.8°
C27N26C31C3042.5°58.6°
C27N26C25H1624.8°78.6°
C27N26C25H1795.8°41.4°
N26C27H18H19118.2°120.1°
N26C27C28H20169.2°176.7°
N26C27C28H2171.8°63.0°
C27N26C31H24163.3°61.3°
C27N26C31H2578.2°178.5°
C22C23C24N1823.6°22.2°
C22C23C24H13119.5°118.3°
C22C23C24H14119.5°118.5°
C23C22C21H9109.1°81.8°
C23C22C21H10131.7°155.9°
C23C22H11H12122.4°123.9°
C22C23H13H14121.6°123.1°
C22C23C24H15140.4°97.2°
C24N18S17O20175.5°28.0°
N18C24C23H15116.9°119.4°
C24N18S17O1952.6°160.9°
C24N18S17C1464.6°85.6°
C24N18C21H995.4°94.7°
C24N18C21H10145.5°143.0°
N18C24C23H1395.9°140.5°
N18C24C23H14143.1°96.3°
N18C24C25H1618.2°67.8°
N18C24C25H17102.5°52.2°
N18S17O20O19124.2°122.9°
N18S17O20C14115.5°114.1°
S17N18C24C23119.1°179.0°
N18S17O19C14113.8°114.1°
N18S17C14C1592.3°90.0°
N18S17C14C1386.4°89.7°
S17N18C21H9119.8°85.3°
S17N18C21H100.7°37.0°
S17N18C24H152.6°59.6°
C28O29C30C3152.4°58.7°
O29C28C27H18169.3°176.7°
O29C28C27H1971.9°63.1°
O29C28H20H21118.4°120.1°
C28O29C30H22172.8°61.2°
C28O29C30H2368.1°178.6°
N26C31C30O2946.2°56.8°
N26C31C30H24120.8°119.9°
N26C31C30H25120.8°119.9°
C31N26C25H16149.5°45.1°
C31N26C25H1728.9°165.1°
C31N26C27H18163.9°178.6°
C31N26C27H1977.2°61.3°
N26C31C30H22166.7°63.1°
N26C31C30H2374.2°176.8°
N26C31H24H25117.7°120.2°
O29C30C31H22120.5°120.0°
O29C30C31H23120.5°120.0°
C30O29C28H20174.5°178.6°
C30O29C28H2166.5°61.2°
O29C30H22H23118.6°120.2°
O29C30C31H24167.0°63.1°
O29C30C31H2574.5°176.8°
O20S17O19C14121.4°123.0°
O20S17C14C1528.6°23.5°
O20S17C14C13152.7°156.7°
C24C23C22H11126.6°82.6°
C24C23C22H12111.7°153.6°
C24C23H13H14121.6°123.4°
C23C24C25H16140.2°50.0°
C23C24C25H1719.5°170.1°
C31C30H22H23118.6°120.1°
C30C31H24H25117.7°120.1°
O19S17C14C15148.8°156.5°
O19S17C14C1332.5°23.8°
S17C14C15C13178.8°179.7°
S17C14C15C16179.2°179.7°
S17C14C13C12179.3°179.7°
S17C14C13H20.7°0.3°
S17C14C15H70.8°0.3°
C14C15C16H7180.0°180.0°
C15C14C13C120.5°0.0°
C14C15C16C110.9°0.0°
C15C14C13H2179.5°180.0°
C14C15C16H8179.1°180.0°
C13C14C15C160.5°0.0°
C14C13C12H2180.0°180.0°
C14C13C12C110.8°0.1°
C14C13C12H1179.2°180.0°
C13C14C15H7179.5°180.0°
C15C16C11H8180.0°180.0°
C15C16C11C122.2°0.1°
C15C16C11N09178.4°179.9°
C13C12C11C162.1°0.1°
C13C12C11H1180.0°179.9°
C13C12C11N09178.3°180.0°
C16C11C12N09176.2°179.8°
C16C11N09C0826.2°144.9°
C16C11C12H1177.9°179.9°
C11C16C15H7179.1°180.0°
C16C11N09H27153.8°35.1°
C12C11N09C08157.8°35.3°
C11C12C13H2179.2°179.9°
C12C11C16H8177.8°179.9°
C12C11N09H2722.2°144.8°
C11N09C08O104.1°5.0°
C11N09C08H27180.0°179.9°
C11N09C08N07177.1°175.0°
N09C11C12H11.7°0.1°
N09C11C16H81.6°0.0°
O10C08N09N07178.8°180.0°
O10C08N07C050.9°5.4°
O10C08N07H26179.2°174.7°
O10C08N09H27175.9°175.1°
N09C08N07C05177.9°174.6°
N09C08N07H262.1°5.3°
C08N07C05H26180.0°180.0°
C08N07C05C0412.5°33.4°
C08N07C05C06168.0°146.4°
N07C08N09H272.9°4.9°
N07C05C04C06179.5°179.7°
N07C05C04C03179.7°180.0°
N07C05C06C01179.7°179.7°
N07C05C04H50.3°0.3°
N07C05C06H60.3°0.2°
C05C04C03H5180.0°179.7°
C05C04C03C020.3°0.1°
C04C05C06C010.7°0.5°
C05C04C03H4179.7°180.0°
C04C05C06H6179.3°179.9°
C04C05N07H26167.5°146.6°
C03C04C05C060.8°0.3°
C04C03C02H4180.0°180.0°
C04C03C02C010.4°0.0°
C04C03C02C32178.7°180.0°
C05C06C01H6180.0°179.5°
C05C06C01C020.1°0.5°
C05C06C01H3179.9°179.7°
C06C05C04H5179.2°180.0°
C06C05N07H2612.0°33.7°
C03C02C01C060.5°0.2°
C03C02C01C32178.4°180.0°
C03C02C32F3511.7°150.0°
C03C02C32F33130.5°90.0°
C03C02C32F34109.3°29.9°
C03C02C01H3179.5°180.0°
C02C03C04H5179.8°179.7°
C06C01C02H3180.0°179.8°
C06C01C02C32178.9°179.8°
C01C02C32F35166.6°30.0°
C01C02C32F3347.9°90.0°
C01C02C32F3472.3°150.0°
C01C02C03H4179.6°180.0°
C02C01C06H6179.9°180.0°
C02C32F35F33124.1°120.0°
C02C32F35F34127.7°120.0°
C02C32F33F34127.0°120.0°
C32C02C01H31.1°0.0°
C32C02C03H41.3°0.1°
F35C32F33F34108.0°119.9°
H1C12C13H20.8°0.0°
H3C01C06H60.1°0.2°
H4C03C04H50.2°0.3°
H7C15C16H80.9°0.1°
H9C21C22H11131.7°160.1°
H9C21C22H1210.0°36.3°
H10C21C22H1112.6°37.7°
H10C21C22H12109.1°86.1°
H11C22C23H137.2°35.8°
H11C22C23H14113.9°158.9°
H12C22C23H13128.8°88.0°
H12C22C23H147.7°35.0°
H13C23C24H1521.0°21.1°
H14C23C24H15100.1°144.3°
H15C24C25H16101.9°171.0°
H15C24C25H17137.5°68.9°
H18C27C28H2070.2°63.3°
H18C27C28H2148.7°56.9°
H19C27C28H2048.6°56.8°
H19C27C28H21167.6°177.0°
H22C30C31H2472.6°176.9°
H22C30C31H2545.9°56.8°
H23C30C31H2446.5°56.9°
H23C30C31H25165.0°63.3°

223532

PDB entries from 2024-08-07

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