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4MG

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C6doub1.32Å1.32ÅAromatic
N1C2sing1.32Å1.33ÅAromatic
C6C5sing1.38Å1.41ÅAromatic
CAHCAIdoub1.38Å1.38ÅAromatic
CAHCASsing1.39Å1.41ÅAromatic
NAPC2sing1.39Å1.32Å
NAPCASsing1.40Å1.35Å
C2N3doub1.32Å1.35ÅAromatic
CAICBAsing1.39Å1.39ÅAromatic
CASCAJdoub1.38Å1.40ÅAromatic
C5C4doub1.39Å1.36ÅAromatic
CBACAZdoub1.41Å1.38ÅAromatic
CBANBDsing1.38Å1.33ÅAromatic
N3C4sing1.33Å1.35ÅAromatic
CAJCAZsing1.40Å1.39ÅAromatic
CADNBDsing1.46Å1.50Å
C4NBEsing1.40Å1.35Å
CAZCAVsing1.47Å1.39ÅAromatic
NBDCAWsing1.37Å1.31ÅAromatic
NBENAOsing1.40Å1.24ÅAromatic
NBECAKsing1.36Å1.34ÅAromatic
CAWCAVdoub1.34Å1.38ÅAromatic
CAWCACsing1.51Å1.52Å
CAVCABsing1.51Å1.51Å
NAOCATdoub1.31Å1.33ÅAromatic
CANCBBsing1.54Å1.50Å
CANNBCsing1.48Å1.45Å
CAKCAUdoub1.35Å1.34ÅAromatic
OAECBBsing1.43Å1.45Å
CBBCAMsing1.54Å1.51Å
CATCAUsing1.40Å1.40ÅAromatic
CATCAAsing1.51Å1.53Å
CAUCALsing1.51Å1.58Å
NBCCAMsing1.48Å1.52Å
NBCCALsing1.47Å1.46Å
CADH1sing1.09Å1.10Å
CADH2sing1.09Å1.10Å
CADH3sing1.09Å1.10Å
CACH4sing1.09Å1.10Å
CACH5sing1.09Å1.10Å
CACH6sing1.09Å1.10Å
CABH7sing1.09Å1.10Å
CABH8sing1.09Å1.10Å
CABH9sing1.09Å1.10Å
CAJH10sing1.08Å1.08Å
CAIH11sing1.08Å1.08Å
CAHH12sing1.08Å1.08Å
NAPH13sing0.97Å1.00Å
C6H14sing1.08Å1.08Å
C5H15sing1.08Å1.08Å
CAKH16sing1.08Å1.08Å
CAAH17sing1.09Å1.10Å
CAAH18sing1.09Å1.10Å
CAAH19sing1.09Å1.10Å
CALH20sing1.09Å1.10Å
CALH21sing1.09Å1.10Å
CANH23sing1.09Å1.10Å
CANH24sing1.09Å1.10Å
CAMH25sing1.09Å1.10Å
CAMH26sing1.09Å1.10Å
CBBH27sing1.09Å1.10Å
OAEH28sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C6N1C2121.7°120.9°
N1C6C5120.0°119.2°
N1C6H14120.0°120.4°
N1C2NAP116.2°119.2°
N1C2N3120.2°121.7°
C6C5C4117.5°118.5°
C5C6H14120.0°120.4°
C6C5H15121.3°120.7°
CAICAHCAS120.9°120.6°
CAHCAICBA119.7°120.0°
CAHCAIH11120.1°120.0°
CAICAHH12119.6°119.7°
CAHCASNAP114.8°119.9°
CAHCASCAJ119.0°120.2°
CASCAHH12119.5°119.7°
C2NAPCAS127.2°120.0°
NAPC2N3123.4°119.2°
C2NAPH13116.4°120.0°
NAPCASCAJ126.2°119.9°
CASNAPH13116.4°120.0°
C2N3C4119.9°120.7°
CAICBACAZ120.0°119.6°
CAICBANBD131.2°133.3°
CBACAIH11120.1°120.0°
CASCAJCAZ119.1°119.6°
CASCAJH10120.4°120.2°
C5C4N3120.6°119.0°
C5C4NBE120.0°120.5°
C4C5H15121.3°120.7°
CAZCBANBD108.8°107.1°
CBACAZCAJ121.2°120.0°
CBACAZCAV105.2°106.1°
CBANBDCAD125.3°125.1°
CBANBDCAW110.2°109.8°
N3C4NBE119.1°120.5°
CAJCAZCAV133.6°133.9°
CAZCAJH10120.5°120.2°
CADNBDCAW124.4°125.1°
NBDCADH1109.5°109.5°
NBDCADH2109.5°109.5°
NBDCADH3109.5°109.4°
C4NBENAO123.6°126.1°
C4NBECAK123.8°126.1°
CAZCAVCAW108.0°107.0°
CAZCAVCAB126.7°126.5°
NBDCAWCAV107.8°110.0°
NBDCAWCAC125.6°125.0°
NAONBECAK112.1°107.8°
NBENAOCAT107.6°108.3°
NBECAKCAU107.9°107.6°
NBECAKH16126.1°126.2°
CAVCAWCAC126.6°125.1°
CAWCAVCAB125.3°126.5°
CAWCACH4109.5°109.4°
CAWCACH5109.5°109.5°
CAWCACH6109.4°109.5°
CAVCABH7109.5°109.4°
CAVCABH8109.5°109.5°
CAVCABH9109.5°109.5°
NAOCATCAU108.7°108.3°
NAOCATCAA122.6°125.8°
CBBCANNBC90.3°86.2°
CANCBBOAE105.3°113.8°
CANCBBCAM83.1°86.3°
CBBCANH23114.0°113.7°
CBBCANH24114.0°113.8°
CANCBBH27115.9°113.7°
CANNBCCAM84.2°90.8°
CANNBCCAL121.3°111.0°
NBCCANH23114.0°113.8°
NBCCANH24114.0°113.8°
CAKCAUCAT103.7°108.0°
CAKCAUCAL124.4°126.0°
CAUCAKH16126.1°126.2°
OAECBBCAM115.3°113.7°
OAECBBH27116.7°113.0°
CBBOAEH28109.5°114.0°
CBBCAMNBC87.3°86.2°
CBBCAMH25114.7°113.8°
CBBCAMH26114.7°113.8°
CAMCBBH27115.6°113.7°
CAUCATCAA128.7°125.8°
CATCAUCAL132.0°126.0°
CATCAAH17109.5°109.5°
CATCAAH18109.5°109.4°
CATCAAH19109.4°109.5°
CAUCALNBC104.3°109.5°
CAUCALH20110.8°109.5°
CAUCALH21110.7°109.5°
CAMNBCCAL112.3°111.0°
NBCCAMH25114.7°113.7°
NBCCAMH26114.7°113.8°
NBCCALH20110.8°109.4°
NBCCALH21110.7°109.4°
H1CADH2109.5°109.5°
H1CADH3109.5°109.5°
H2CADH3109.5°109.5°
H4CACH5109.4°109.4°
H4CACH6109.5°109.5°
H5CACH6109.5°109.5°
H7CABH8109.5°109.4°
H7CABH9109.5°109.5°
H8CABH9109.5°109.5°
H17CAAH18109.4°109.5°
H17CAAH19109.5°109.5°
H18CAAH19109.5°109.5°
H20CALH21109.5°109.5°
H23CANH24109.5°113.0°
H25CAMH26109.5°113.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C6C5H14180.0°180.0°
C6N1C2NAP178.3°180.0°
C6N1C2N33.7°0.3°
N1C6C5C42.1°0.2°
N1C6C5H15177.9°180.0°
C2N1C6C50.9°0.0°
N1C2NAPN3174.4°179.7°
N1C2NAPCAS178.4°5.0°
N1C2N3C43.5°0.3°
N1C2NAPH131.6°175.0°
C2N1C6H14179.1°180.0°
C6C5C4H15180.0°179.7°
C6C5C4N32.3°0.3°
C6C5C4NBE176.2°179.7°
CAICAHCASH12180.0°179.9°
CAICAHCASNAP178.0°180.0°
CAHCAICBAH11180.0°180.0°
CAICAHCASCAJ0.0°0.1°
CAHCAICBACAZ0.3°0.0°
CAHCAICBANBD179.9°179.5°
CAHCASNAPC2179.0°147.1°
CAHCASNAPCAJ177.8°179.9°
CASCAHCAICBA0.4°0.2°
CAHCASCAJCAZ0.6°0.2°
CAHCASCAJH10179.3°179.9°
CASCAHCAIH11179.6°179.8°
CAHCASNAPH131.1°32.8°
C2NAPCASH13180.0°179.9°
C2NAPCASCAJ3.3°33.0°
NAPC2N3C4177.7°179.9°
CASNAPC2N37.3°174.7°
NAPCASCAJCAZ178.3°179.7°
NAPCASCAJH101.6°0.2°
NAPCASCAHH122.0°0.1°
C2N3C4C50.5°0.0°
C2N3C4NBE173.5°180.0°
N3C2NAPH13172.7°5.3°
CAICBACAZNBD179.7°179.6°
CAICBACAZCAJ0.3°0.3°
CAICBANBDCAD1.2°0.3°
CAICBACAZCAV179.8°180.0°
CAICBANBDCAW179.9°179.9°
CBACAICAHH12179.6°179.9°
CASCAJCAZCBA0.8°0.3°
CASCAJCAZH10180.0°180.0°
CASCAJCAZCAV179.9°180.0°
CAJCASCAHH12180.0°180.0°
CAJCASNAPH13176.7°147.1°
C5C4N3NBE174.0°180.0°
C5C4NBENAO4.0°0.1°
C5C4NBECAK166.9°179.7°
C4C5C6H14177.9°179.7°
CBACAZCAJCAV179.3°179.6°
CAZCBANBDCAD179.1°179.8°
CAZCBANBDCAW0.4°0.4°
CBACAZCAVCAW0.2°0.3°
CBACAZCAVCAB178.9°179.7°
CBACAZCAJH10179.2°179.7°
CAZCBACAIH11179.7°180.0°
NBDCBACAZCAJ179.4°179.8°
CBANBDCADCAW178.5°179.8°
NBDCBACAZCAV0.1°0.4°
CBANBDCAWCAV0.5°0.2°
CBANBDCAWCAC179.9°179.7°
CBANBDCADH1180.0°90.2°
CBANBDCADH260.0°29.8°
CBANBDCADH360.0°149.8°
NBDCBACAIH110.1°0.5°
N3C4NBENAO178.1°180.0°
N3C4NBECAK7.1°0.3°
N3C4C5H15177.7°180.0°
CAJCAZCAVCAW179.6°180.0°
CAJCAZCAVCAB0.5°0.1°
CADNBDCAWCAV179.3°180.0°
CADNBDCAWCAC1.4°0.1°
NBDCADH1H2120.0°120.0°
NBDCADH1H3120.0°120.0°
NBDCADH2H3120.0°120.0°
C4NBENAOCAK171.9°179.7°
C4NBENAOCAT176.1°180.0°
C4NBECAKCAU175.5°180.0°
NBEC4C5H153.8°0.0°
C4NBECAKH164.5°0.0°
CAZCAVCAWNBD0.5°0.1°
CAZCAVCAWCAB179.1°179.9°
CAZCAVCAWCAC179.8°180.0°
CAZCAVCABH790.6°90.0°
CAZCAVCABH8149.4°29.9°
CAZCAVCABH929.5°150.0°
CAVCAZCAJH100.1°0.1°
NBDCAWCAVCAC179.3°179.9°
NBDCAWCAVCAB178.7°180.0°
CAWNBDCADH11.5°90.0°
CAWNBDCADH2118.5°150.0°
CAWNBDCADH3121.5°30.0°
NBDCAWCACH489.6°90.0°
NBDCAWCACH5150.4°150.1°
NBDCAWCACH630.4°30.0°
NAONBECAKCAU3.6°0.3°
NBENAOCATCAU3.3°0.2°
NBENAOCATCAA178.3°179.9°
NAONBECAKH16176.4°179.7°
CAKNBENAOCAT4.2°0.3°
NBECAKCAUH16180.0°180.0°
NBECAKCAUCAT1.3°0.2°
NBECAKCAUCAL179.4°180.0°
CAVCAWCACH489.6°89.9°
CAVCAWCACH530.4°30.0°
CAVCAWCACH6150.4°150.0°
CAWCAVCABH790.5°90.0°
CAWCAVCABH829.5°150.0°
CAWCAVCABH9149.5°30.0°
CACCAWCAVCAB0.7°0.0°
CAWCACH4H5120.0°120.0°
CAWCACH4H6120.0°120.0°
CAWCACH5H6120.0°120.1°
CAVCABH7H8120.0°119.9°
CAVCABH7H9120.0°120.0°
CAVCABH8H9120.0°120.1°
NAOCATCAUCAK1.1°0.0°
NAOCATCAUCAA178.3°179.9°
NAOCATCAUCAL178.1°179.8°
NAOCATCAAH170.0°90.0°
NAOCATCAAH18120.0°150.0°
NAOCATCAAH19120.0°30.0°
CBBCANNBCH23116.6°114.3°
CBBCANNBCH24116.6°114.3°
CANCBBOAECAM89.5°96.7°
CANCBBOAEH27130.0°131.7°
CANCBBCAMH27115.4°114.3°
CBBCANNBCCAM29.1°24.7°
CBBCANNBCCAL141.8°137.6°
CBBCANH23H24129.1°131.7°
CANCBBCAMH2588.0°138.0°
CANCBBCAMH26144.1°90.6°
CANCBBOAEH28180.0°179.9°
NBCCANCBBOAE143.8°138.1°
CANNBCCALCAU74.6°90.6°
CANNBCCAMCAL121.5°112.9°
CANNBCCALH20166.2°149.3°
CANNBCCALH2144.6°29.4°
NBCCANH23H24129.1°131.7°
CANNBCCAMH2587.1°139.0°
CANNBCCAMH26144.9°89.7°
NBCCANCBBH2785.7°90.6°
CAKCAUCATCAL179.2°179.8°
CAKCAUCATCAA179.4°179.9°
CAKCAUCALNBC88.4°100.0°
CAKCAUCALH20152.4°20.0°
CAKCAUCALH2130.7°140.0°
OAECBBCAMH27140.9°131.2°
OAECBBCAMNBC131.7°138.1°
OAECBBCANH2399.6°23.8°
OAECBBCANH2427.2°107.6°
OAECBBCAMH2515.7°107.6°
OAECBBCAMH26112.3°23.8°
CBBCAMNBCH25116.0°114.3°
CBBCAMNBCH26116.0°114.4°
CBBCAMNBCCAL150.4°137.6°
CAMCBBCANH23146.1°90.6°
CAMCBBCANH2487.2°138.1°
CBBCAMH25H26130.6°131.8°
CAMCBBOAEH2890.5°83.2°
CATCAUCALNBC90.7°80.2°
CATCAUCAKH16178.7°179.8°
CAUCATCAAH17178.1°90.1°
CAUCATCAAH1861.9°29.9°
CAUCATCAAH1958.1°149.9°
CATCAUCALH2028.5°159.8°
CATCAUCALH21150.2°39.7°
CAACATCAUCAL0.2°0.1°
CATCAAH17H18120.0°120.0°
CATCAAH17H19120.0°120.0°
CATCAAH18H19120.0°120.0°
CAUCALNBCCAM171.5°170.0°
CAUCALNBCH20119.2°120.0°
CAUCALNBCH21119.2°120.0°
CALCAUCAKH160.6°0.0°
CAUCALH20H21122.4°120.1°
CAMNBCCALH2069.3°50.0°
CAMNBCCALH2152.4°70.0°
CAMNBCCANH23145.8°89.6°
CAMNBCCANH2487.5°139.0°
NBCCAMH25H26130.6°131.7°
NBCCAMCBBH2787.4°90.6°
NBCCALH20H21122.4°119.9°
CALNBCCANH23101.6°23.3°
CALNBCCANH2425.2°108.1°
CALNBCCAMH2534.4°108.1°
CALNBCCAMH2693.5°23.2°
H1CADH2H3120.0°120.0°
H4CACH5H6120.0°120.0°
H7CABH8H9120.0°120.0°
H11CAICAHH120.4°0.1°
H14C6C5H152.1°0.0°
H17CAAH18H19120.0°120.0°
H23CANCBBH2730.9°155.1°
H24CANCBBH27157.7°23.8°
H25CAMCBBH27156.6°23.7°
H26CAMCBBH2728.7°155.0°
H27CBBOAEH2850.0°48.4°

222415

PDB entries from 2024-07-10

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