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7HE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
FENDsing1.83Å1.94Å
FENCsing1.86Å2.07Å
FENAsing1.86Å2.03Å
FENBsing1.83Å2.04Å
CHAC4Ddoub1.38Å1.41Å
CHAC1Asing1.42Å1.38Å
CHAHHAsing1.08Å1.08Å
CHBC4Asing1.42Å1.42Å
CHBC1Bdoub1.38Å1.47Å
CHBHHBsing1.08Å1.08Å
CHCC1Csing1.47Å1.37Å
CHCC4Bdoub1.36Å1.40Å
CHCHHCsing1.08Å1.08Å
CHDC1Ddoub1.38Å1.32Å
CHDC4Csing1.41Å1.37Å
CHDHHDsing1.08Å1.08Å
NAC1Asing1.38Å1.34ÅAromatic
NAC4Asing1.38Å1.42ÅAromatic
C1AC2Adoub1.37Å1.49ÅAromatic
C2ACAAsing1.51Å1.62Å
C2AC3Asing1.42Å1.30ÅAromatic
C3AC4Adoub1.37Å1.41ÅAromatic
C3ACMAsing1.51Å1.55Å
CMAHMA1sing1.09Å1.10Å
CMAHMA2sing1.09Å1.10Å
CMAHMA3sing1.09Å1.10Å
CAAHAA1sing1.09Å1.10Å
CAAHAA2sing1.09Å1.10Å
CAAHAA3sing1.09Å1.10Å
NBC4Bsing1.40Å1.32Å
NBC1Bsing1.40Å1.41Å
C1BC2Bsing1.40Å1.39Å
C2BC3Bdoub1.40Å1.43Å
C2BCMBsing1.51Å1.52Å
C3BC4Bsing1.46Å1.42Å
C3BCABsing1.47Å1.50Å
CMBHMB1sing1.09Å1.10Å
CMBHMB2sing1.09Å1.10Å
CMBHMB3sing1.09Å1.10Å
CABCBBdoub1.33Å1.33Å
CABHABsing1.08Å1.08Å
CBBHBB1sing1.08Å1.08Å
CBBHBB2sing1.08Å1.08Å
NCC4Csing1.38Å1.32ÅAromatic
NCC1Csing1.38Å1.38ÅAromatic
C1CC2Cdoub1.35Å1.42ÅAromatic
C2CC3Csing1.44Å1.36ÅAromatic
C2CCMCsing1.51Å1.51Å
C3CCACsing1.47Å1.48Å
C3CC4Cdoub1.39Å1.44ÅAromatic
CMCHMC1sing1.09Å1.10Å
CMCHMC2sing1.09Å1.10Å
CMCHMC3sing1.09Å1.10Å
CACCBCdoub1.33Å1.29Å
CACHACsing1.08Å1.08Å
CBCHBC1sing1.08Å1.08Å
CBCHBC2sing1.08Å1.08Å
NDC1Dsing1.39Å1.39Å
NDC4Dsing1.40Å1.37Å
C1DC2Dsing1.41Å1.52Å
C2DCMDsing1.51Å1.50Å
C2DC3Ddoub1.38Å1.32Å
C3DCADsing1.51Å1.52Å
C3DC4Dsing1.41Å1.47Å
CMDHMD1sing1.09Å1.10Å
CMDHMD2sing1.09Å1.10Å
CMDHMD3sing1.09Å1.10Å
CADCBDsing1.53Å1.53Å
CADHAD1sing1.09Å1.10Å
CADHAD2sing1.09Å1.10Å
CBDCGDsing1.51Å1.51Å
CBDHBD1sing1.09Å1.10Å
CBDHBD2sing1.09Å1.10Å
CGDO1Ddoub1.21Å1.22Å
CGDO2Dsing1.34Å1.34Å
O2DHO2Dsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NDFENC88.3°98.8°
NDFENA90.8°98.8°
NDFENB174.1°137.8°
FENDC1D129.9°124.2°
FENDC4D128.7°124.3°
NCFENA177.1°128.6°
NCFENB88.3°99.3°
FENCC4C126.3°123.4°
FENCC1C125.0°123.3°
NAFENB92.4°99.0°
FENAC1A123.5°123.4°
FENAC4A127.3°123.4°
FENBC4B131.8°124.3°
FENBC1B124.3°123.9°
C4DCHAC1A122.5°127.3°
C4DCHAHHA118.7°116.3°
CHAC4DND124.5°121.8°
CHAC4DC3D120.0°135.1°
C1ACHAHHA118.8°116.4°
CHAC1ANA128.4°121.7°
CHAC1AC2A127.2°137.2°
C4ACHBC1B124.3°127.4°
C4ACHBHHB117.9°116.3°
CHBC4ANA124.4°121.6°
CHBC4AC3A124.4°137.3°
C1BCHBHHB117.8°116.3°
CHBC1BNB126.6°121.7°
CHBC1BC2B121.1°134.0°
C1CCHCC4B131.0°126.7°
C1CCHCHHC114.5°116.7°
CHCC1CNC123.7°121.2°
CHCC1CC2C125.7°137.1°
C4BCHCHHC114.5°116.6°
CHCC4BNB119.3°122.5°
CHCC4BC3B126.3°135.0°
C1DCHDC4C133.2°127.4°
C1DCHDHHD113.4°116.3°
CHDC1DND118.9°121.8°
CHDC1DC2D127.5°135.1°
C4CCHDHHD113.4°116.3°
CHDC4CNC120.4°121.8°
CHDC4CC3C128.0°137.5°
C1ANAC4A108.7°109.1°
NAC1AC2A102.1°101.0°
NAC4AC3A111.0°101.0°
C1AC2ACAA120.4°126.1°
C1AC2AC3A115.3°107.8°
CAAC2AC3A124.2°126.1°
C2ACAAHAA1109.5°109.5°
C2ACAAHAA2109.5°109.5°
C2ACAAHAA3109.4°109.5°
C2AC3AC4A102.4°107.7°
C2AC3ACMA131.6°126.2°
C4AC3ACMA125.6°126.1°
C3ACMAHMA1109.5°109.5°
C3ACMAHMA2109.5°109.4°
C3ACMAHMA3109.5°109.4°
HMA1CMAHMA2109.5°109.5°
HMA1CMAHMA3109.5°109.5°
HMA2CMAHMA3109.5°109.5°
HAA1CAAHAA2109.5°109.4°
HAA1CAAHAA3109.4°109.4°
HAA2CAAHAA3109.5°109.5°
C4BNBC1B103.9°106.0°
NBC4BC3B114.3°102.2°
NBC1BC2B112.1°104.0°
C1BC2BC3B105.8°107.6°
C1BC2BCMB128.0°126.2°
C3BC2BCMB126.2°126.2°
C2BC3BC4B104.0°106.1°
C2BC3BCAB128.3°127.0°
C2BCMBHMB1109.5°109.5°
C2BCMBHMB2109.5°109.5°
C2BCMBHMB3109.5°109.5°
C4BC3BCAB127.6°126.9°
C3BCABCBB126.3°120.0°
C3BCABHAB116.8°120.0°
HMB1CMBHMB2109.5°109.5°
HMB1CMBHMB3109.5°109.5°
HMB2CMBHMB3109.5°109.5°
CBBCABHAB116.9°120.0°
CABCBBHBB1120.0°120.0°
CABCBBHBB2120.0°120.0°
HBB1CBBHBB2120.0°120.0°
C4CNCC1C106.0°109.4°
NCC4CC3C110.7°100.7°
NCC1CC2C110.5°101.7°
C1CC2CC3C105.7°107.8°
C1CC2CCMC123.9°126.2°
C3CC2CCMC130.3°126.1°
C2CC3CCAC129.0°126.5°
C2CC3CC4C106.3°107.1°
C2CCMCHMC1109.5°109.5°
C2CCMCHMC2109.4°109.5°
C2CCMCHMC3109.5°109.5°
CACC3CC4C123.1°126.4°
C3CCACCBC127.4°120.0°
C3CCACHAC116.3°120.0°
HMC1CMCHMC2109.5°109.5°
HMC1CMCHMC3109.5°109.4°
HMC2CMCHMC3109.5°109.4°
CBCCACHAC116.3°120.0°
CACCBCHBC1120.0°120.0°
CACCBCHBC2120.0°120.0°
HBC1CBCHBC2120.0°120.0°
C1DNDC4D101.2°105.4°
NDC1DC2D111.1°102.8°
NDC4DC3D115.5°102.7°
C1DC2DCMD123.5°126.3°
C1DC2DC3D106.2°107.3°
CMDC2DC3D129.7°126.3°
C2DCMDHMD1109.5°109.4°
C2DCMDHMD2109.4°109.4°
C2DCMDHMD3109.5°109.5°
C2DC3DCAD129.7°126.3°
C2DC3DC4D105.2°107.5°
CADC3DC4D124.3°126.3°
C3DCADCBD108.3°109.4°
C3DCADHAD1109.9°109.5°
C3DCADHAD2109.9°109.4°
HMD1CMDHMD2109.5°109.5°
HMD1CMDHMD3109.5°109.5°
HMD2CMDHMD3109.5°109.5°
CBDCADHAD1109.9°109.5°
CBDCADHAD2109.9°109.5°
CADCBDCGD111.0°109.5°
CADCBDHBD1109.0°109.5°
CADCBDHBD2108.9°109.5°
HAD1CADHAD2109.0°109.5°
CGDCBDHBD1108.9°109.5°
CGDCBDHBD2109.0°109.5°
CBDCGDO1D118.8°120.0°
CBDCGDO2D119.2°120.0°
HBD1CBDHBD2110.0°109.4°
O1DCGDO2D121.1°120.0°
CGDO2DHO2D109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NDFENCNA71.2°108.7°
NDFENCNB175.2°141.8°
NDFENANB175.0°141.6°
FENDC4DCHA0.2°15.5°
FENDC1DCHD14.1°15.4°
NDFENAC1A9.2°6.8°
NDFENAC4A179.1°148.3°
NDFENBC4B55.6°105.7°
NDFENBC1B128.2°104.9°
NDFENCC4C9.8°6.9°
NDFENCC1C168.4°148.4°
FENDC1DC4D175.3°153.2°
FENDC1DC2D177.6°170.2°
FENDC4DC3D178.5°170.3°
NCFENANB103.8°109.6°
FENCC1CCHC7.6°15.8°
FENCC4CCHD19.1°15.9°
NCFENAC1A80.4°102.0°
NCFENAC4A108.0°102.9°
NCFENBC4B0.7°8.7°
NCFENBC1B176.9°140.7°
FENCC4CC1C161.9°158.2°
FENCC1CC2C168.9°165.4°
FENCC4CC3C171.2°165.9°
NCFENDC1D6.8°8.3°
NCFENDC4D179.0°140.0°
FENAC1ACHA17.2°16.0°
FENAC4ACHB4.8°16.0°
FENAC1AC4A173.0°158.1°
FENAC1AC2A179.5°165.9°
FENAC4AC3A180.0°165.9°
NAFENBC4B177.9°140.5°
NAFENBC1B5.8°9.0°
NAFENCC4C61.4°101.9°
NAFENCC1C97.2°102.9°
NAFENDC1D175.9°139.8°
NAFENDC4D1.7°8.5°
FENBC1BCHB8.7°16.2°
FENBC4BCHC7.6°15.5°
NBFENAC1A175.8°148.4°
NBFENAC4A4.1°6.7°
FENBC4BC1B176.8°154.0°
FENBC1BC2B177.0°168.7°
FENBC4BC3B176.4°169.9°
NBFENCC4C165.4°148.6°
NBFENCC1C6.7°6.6°
NBFENDC1D61.7°106.2°
NBFENDC4D124.2°105.4°
C4DCHAC1AHHA180.0°180.0°
C4DCHAC1ANA14.6°10.3°
C4DCHAC1AC2A174.0°172.4°
CHAC4DNDC1D175.6°137.8°
CHAC4DNDC3D178.7°174.2°
CHAC4DC3DC2D178.7°150.9°
CHAC4DC3DCAD8.3°29.1°
CHAC1ANAC2A163.3°178.1°
CHAC1ANAC4A169.8°142.2°
CHAC1AC2ACAA15.1°23.2°
CHAC1AC2AC3A167.8°156.8°
C1ACHAC4DND5.0°6.4°
C1ACHAC4DC3D173.6°178.5°
HHACHAC1ANA165.4°169.7°
HHACHAC1AC2A6.0°7.6°
HHACHAC4DND175.0°173.6°
HHACHAC4DC3D6.4°1.6°
C4ACHBC1BHHB180.0°179.9°
CHBC4ANAC1A177.4°142.1°
CHBC4ANAC3A175.3°178.1°
CHBC4AC3AC2A179.6°156.7°
CHBC4AC3ACMA6.5°23.4°
C4ACHBC1BNB8.1°7.1°
C4ACHBC1BC2B178.1°179.7°
C1BCHBC4ANA5.8°10.1°
C1BCHBC4AC3A179.6°172.6°
CHBC1BNBC4B174.2°137.9°
CHBC1BNBC2B174.2°175.0°
CHBC1BC2BC3B174.8°151.7°
CHBC1BC2BCMB6.7°28.3°
HHBCHBC4ANA174.2°169.8°
HHBCHBC4AC3A0.4°7.5°
HHBCHBC1BNB171.9°173.0°
HHBCHBC1BC2B1.9°0.2°
C1CCHCC4BHHC180.0°179.9°
C1CCHCC4BNB9.1°6.2°
C1CCHCC4BC3B175.4°178.7°
CHCC1CNCC4C169.8°142.4°
CHCC1CNCC2C176.5°178.8°
CHCC1CC2CC3C175.0°157.5°
CHCC1CC2CCMC2.4°22.4°
CHCC4BNBC3B176.0°174.6°
CHCC4BNBC1B175.7°138.5°
CHCC4BC3BC2B175.2°151.9°
CHCC4BC3BCAB1.5°28.1°
C4BCHCC1CNC1.2°10.5°
C4BCHCC1CC2C177.1°171.3°
HHCCHCC4BNB171.0°173.9°
HHCCHCC4BC3B4.6°1.3°
HHCCHCC1CNC178.8°169.4°
HHCCHCC1CC2C2.9°8.8°
C1DCHDC4CHHD180.0°179.9°
C1DCHDC4CNC12.3°10.0°
C1DCHDC4CC3C179.9°172.5°
CHDC1DNDC2D163.5°174.4°
CHDC1DNDC4D170.5°137.9°
CHDC1DC2DCMD17.3°28.9°
CHDC1DC2DC3D170.9°151.1°
CHDC4CNCC3C169.7°178.3°
CHDC4CNCC1C179.0°142.3°
CHDC4CC3CC2C177.4°156.9°
CHDC4CC3CCAC15.9°23.1°
C4CCHDC1DND4.9°6.6°
C4CCHDC1DC2D165.4°178.9°
HHDCHDC4CNC167.7°170.0°
HHDCHDC4CC3C0.1°7.4°
HHDCHDC1DND175.1°173.3°
HHDCHDC1DC2D14.6°1.1°
NAC1AC2ACAA178.7°159.1°
NAC1AC2AC3A4.3°20.9°
C1ANAC4AC3A7.3°36.0°
C4ANAC1AC2A6.5°36.0°
NAC4AC3AC2A4.3°21.0°
NAC4AC3ACMA178.3°159.0°
C1AC2ACAAC3A176.8°180.0°
C1AC2AC3AC4A0.1°0.0°
C1AC2AC3ACMA173.5°179.9°
C1AC2ACAAHAA188.5°90.0°
C1AC2ACAAHAA2151.5°150.0°
C1AC2ACAAHAA331.5°30.0°
CAAC2AC3AC4A176.9°179.9°
CAAC2AC3ACMA3.5°0.1°
C2ACAAHAA1HAA2120.0°120.0°
C2ACAAHAA1HAA3120.0°120.0°
C2ACAAHAA2HAA3120.0°120.1°
C2AC3AC4ACMA174.0°180.0°
C2AC3ACMAHMA185.6°90.0°
C2AC3ACMAHMA2154.4°150.0°
C2AC3ACMAHMA334.3°30.0°
C3AC2ACAAHAA188.3°90.0°
C3AC2ACAAHAA231.7°30.0°
C3AC2ACAAHAA3151.7°150.0°
C4AC3ACMAHMA186.5°90.0°
C4AC3ACMAHMA233.5°30.0°
C4AC3ACMAHMA3153.5°150.0°
C3ACMAHMA1HMA2120.0°120.0°
C3ACMAHMA1HMA3120.0°120.0°
C3ACMAHMA2HMA3120.0°119.9°
HMA1CMAHMA2HMA3120.0°120.1°
HAA1CAAHAA2HAA3120.0°119.9°
C4BNBC1BC2B0.1°37.1°
NBC4BC3BC2B0.5°21.7°
NBC4BC3BCAB177.2°158.3°
NBC1BC2BC3B0.2°22.4°
NBC1BC2BCMB178.7°157.6°
C1BNBC4BC3B0.4°36.1°
C1BC2BC3BCMB178.5°180.0°
C1BC2BC3BC4B0.4°0.3°
C1BC2BC3BCAB177.1°179.6°
C1BC2BCMBHMB1180.0°90.0°
C1BC2BCMBHMB260.0°150.0°
C1BC2BCMBHMB360.0°30.0°
C2BC3BC4BCAB176.7°180.0°
C3BC2BCMBHMB11.8°90.0°
C3BC2BCMBHMB2121.8°30.0°
C3BC2BCMBHMB3118.2°150.0°
C2BC3BCABCBB39.3°180.0°
C2BC3BCABHAB140.7°0.0°
CMBC2BC3BC4B178.9°179.6°
CMBC2BC3BCAB4.4°0.4°
C2BCMBHMB1HMB2120.0°120.0°
C2BCMBHMB1HMB3120.0°120.0°
C2BCMBHMB2HMB3120.0°120.0°
C4BC3BCABCBB136.5°0.0°
C4BC3BCABHAB43.4°180.0°
C3BCABCBBHAB180.0°180.0°
C3BCABCBBHBB1180.0°180.0°
C3BCABCBBHBB20.0°0.0°
HMB1CMBHMB2HMB3120.0°120.0°
CABCBBHBB1HBB2180.0°179.9°
HABCABCBBHBB10.0°0.0°
HABCABCBBHBB2180.0°180.0°
C4CNCC1CC2C6.7°36.4°
NCC4CC3CC2C8.7°20.9°
NCC4CC3CCAC175.4°159.0°
NCC1CC2CC3C1.3°21.0°
NCC1CC2CCMC178.8°159.2°
C1CNCC4CC3C9.3°35.9°
C1CC2CC3CCMC177.2°179.9°
C1CC2CC3CCAC169.8°180.0°
C1CC2CC3CC4C4.1°0.0°
C1CC2CCMCHMC191.4°90.0°
C1CC2CCMCHMC2148.6°149.9°
C1CC2CCMCHMC328.6°29.9°
C2CC3CCACC4C163.5°179.9°
C3CC2CCMCHMC191.8°90.2°
C3CC2CCMCHMC228.2°29.9°
C3CC2CCMCHMC3148.2°149.9°
C2CC3CCACCBC15.3°50.1°
C2CC3CCACHAC164.7°130.0°
CMCC2CC3CCAC7.5°0.2°
CMCC2CC3CC4C173.1°179.9°
C2CCMCHMC1HMC2120.0°120.1°
C2CCMCHMC1HMC3120.0°120.0°
C2CCMCHMC2HMC3120.0°120.0°
C3CCACCBCHAC180.0°180.0°
C3CCACCBCHBC1180.0°0.0°
C3CCACCBCHBC20.0°180.0°
C4CC3CCACCBC178.8°130.0°
C4CC3CCACHAC1.2°50.0°
HMC1CMCHMC2HMC3120.0°119.9°
CACCBCHBC1HBC2179.9°180.0°
HACCACCBCHBC10.0°180.0°
HACCACCBCHBC2180.0°0.0°
NDC1DC2DCMD179.0°157.8°
NDC1DC2DC3D9.2°22.2°
C1DNDC4DC3D3.1°36.5°
C4DNDC1DC2D7.1°36.5°
NDC4DC3DC2D2.5°22.2°
NDC4DC3DCAD172.9°157.8°
C1DC2DCMDC3D169.8°180.0°
C1DC2DC3DCAD176.2°180.0°
C1DC2DC3DC4D6.5°0.0°
C1DC2DCMDHMD1180.0°90.1°
C1DC2DCMDHMD260.0°150.0°
C1DC2DCMDHMD360.0°30.0°
CMDC2DC3DCAD12.7°0.0°
CMDC2DC3DC4D177.7°180.0°
C2DCMDHMD1HMD2120.0°120.0°
C2DCMDHMD1HMD3120.0°120.0°
C2DCMDHMD2HMD3120.0°120.0°
C2DC3DCADC4D167.9°180.0°
C3DC2DCMDHMD110.2°90.0°
C3DC2DCMDHMD2130.2°30.0°
C3DC2DCMDHMD3109.8°150.0°
C2DC3DCADCBD78.3°95.0°
C2DC3DCADHAD141.7°145.0°
C2DC3DCADHAD2161.6°24.9°
C3DCADCBDHAD1120.0°120.0°
C3DCADCBDHAD2120.0°119.9°
C3DCADHAD1HAD2120.5°120.0°
C3DCADCBDCGD175.1°180.0°
C3DCADCBDHBD164.9°60.0°
C3DCADCBDHBD255.1°60.0°
C4DC3DCADCBD89.6°85.0°
C4DC3DCADHAD1150.4°35.0°
C4DC3DCADHAD230.5°155.0°
HMD1CMDHMD2HMD3120.0°120.1°
CBDCADHAD1HAD2120.5°120.0°
CADCBDCGDHBD1120.0°120.0°
CADCBDCGDHBD2120.0°120.0°
CADCBDHBD1HBD2119.4°120.0°
CADCBDCGDO1D89.0°0.0°
CADCBDCGDO2D102.1°180.0°
HAD1CADCBDCGD55.1°59.9°
HAD1CADCBDHBD1175.1°180.0°
HAD1CADCBDHBD264.9°60.0°
HAD2CADCBDCGD64.9°60.1°
HAD2CADCBDHBD155.1°60.0°
HAD2CADCBDHBD2175.1°180.0°
CGDCBDHBD1HBD2119.4°120.0°
CBDCGDO1DO2D168.7°180.0°
CBDCGDO2DHO2D168.7°180.0°
HBD1CBDCGDO1D151.0°120.0°
HBD1CBDCGDO2D17.9°60.0°
HBD2CBDCGDO1D31.0°120.0°
HBD2CBDCGDO2D138.0°60.0°
O1DCGDO2DHO2D0.0°0.0°

223790

PDB entries from 2024-08-14

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