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K3H

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N6C6sing1.38Å1.27Å
N7C5sing1.35Å1.29ÅAromatic
N7C8doub1.30Å1.29ÅAromatic
C6C5doub1.40Å1.32ÅAromatic
C6N1sing1.33Å1.25ÅAromatic
C5C4sing1.41Å1.29ÅAromatic
C8N9sing1.36Å1.30ÅAromatic
N1C2doub1.32Å1.31ÅAromatic
CBHOAGsing1.43Å1.34Å
CBHCBGsing1.55Å1.48Å
CBHCBLsing1.55Å1.48Å
C4N9sing1.37Å1.29ÅAromatic
C4N3doub1.33Å1.26ÅAromatic
OAFCBGsing1.43Å1.32Å
N9CBLsing1.47Å1.42Å
CBGCBKsing1.54Å1.45Å
C2N3sing1.32Å1.30ÅAromatic
CBLOAXsing1.44Å1.34Å
OAXCBKsing1.44Å1.31Å
CBKCAPsing1.53Å1.50Å
CAPNBNsing1.47Å1.43Å
NACCAZsing1.38Å1.28Å
CAZNARdoub1.33Å1.28ÅAromatic
CAZCBCsing1.41Å1.31ÅAromatic
NBNCAAsing1.47Å1.43Å
NBNCAOsing1.47Å1.46Å
NAVCBCsing1.35Å1.29ÅAromatic
NAVCBAdoub1.31Å1.29ÅAromatic
NARCALsing1.32Å1.32ÅAromatic
CBCCBEdoub1.41Å1.30ÅAromatic
O5'C5'sing1.43Å1.37Å
CBACAJsing1.43Å1.30Å
CBANBPsing1.37Å1.29ÅAromatic
CAJCAItrip1.17Å1.10Å
CAICAOsing1.47Å1.52Å
CALNATdoub1.32Å1.35ÅAromatic
CBENATsing1.33Å1.30ÅAromatic
CBENBPsing1.37Å1.29ÅAromatic
O4'C4'sing1.44Å1.36Å
O4'C1'sing1.44Å1.33Å
NBPC1'sing1.46Å1.41Å
C5'C4'sing1.53Å1.50Å
C4'C3'sing1.54Å1.48Å
C1'C2'sing1.55Å1.48Å
C2'C3'sing1.55Å1.49Å
C2'O2'sing1.43Å1.36Å
C3'O3'sing1.43Å1.33Å
C8H1sing1.08Å1.08Å
C1'H2sing1.09Å1.10Å
C2H3sing1.08Å1.08Å
C2'H4sing1.09Å1.10Å
C3'H5sing1.09Å1.10Å
C4'H6sing1.09Å1.10Å
C5'H7sing1.09Å1.10Å
C5'H8sing1.09Å1.10Å
CAAH9sing1.09Å1.10Å
CAAH10sing1.09Å1.10Å
CAAH11sing1.09Å1.10Å
CALH12sing1.08Å1.08Å
CAOH13sing1.09Å1.10Å
CAOH14sing1.09Å1.10Å
CAPH15sing1.09Å1.10Å
CAPH16sing1.09Å1.10Å
CBGH17sing1.09Å1.10Å
CBHH18sing1.09Å1.10Å
CBKH19sing1.09Å1.10Å
CBLH20sing1.09Å1.10Å
N6H21sing0.97Å1.00Å
N6H22sing0.97Å1.00Å
NACH23sing0.97Å1.00Å
NACH24sing0.97Å1.00Å
O2'H26sing0.97Å0.95Å
O3'H27sing0.97Å0.95Å
O5'H28sing0.97Å0.95Å
OAFH29sing0.97Å0.95Å
OAGH30sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N6C6C5120.7°120.8°
N6C6N1117.1°120.8°
C6N6H21109.5°120.0°
C6N6H22109.4°120.0°
C5N7C8109.2°109.5°
N7C5C6133.5°134.7°
N7C5C4106.0°107.1°
N7C8N9108.0°110.0°
N7C8H1126.0°125.0°
C5C6N1122.2°118.5°
C6C5C4120.5°118.2°
C6N1C2116.3°121.2°
C5C4N9110.4°106.0°
C5C4N3118.0°119.1°
C8N9C4106.4°107.5°
C8N9CBL127.8°126.3°
N9C8H1126.0°125.1°
N1C2N3122.2°122.4°
N1C2H3118.9°118.8°
OAGCBHCBG108.4°110.9°
OAGCBHCBL109.0°110.9°
OAGCBHH18114.4°110.8°
CBHOAGH30109.5°114.0°
CBGCBHCBL100.4°102.1°
CBHCBGOAF111.6°110.6°
CBHCBGCBK98.7°104.2°
CBHCBGH17110.5°110.4°
CBGCBHH18111.9°111.0°
CBHCBLN9112.8°110.6°
CBHCBLOAX104.5°103.5°
CBLCBHH18111.9°110.9°
CBHCBLH20109.3°110.6°
N9C4N3131.6°134.9°
C4N9CBL125.8°126.3°
C4N3C2120.8°120.6°
OAFCBGCBK111.1°110.5°
OAFCBGH17113.1°110.4°
CBGOAFH29109.5°114.0°
N9CBLOAX108.5°110.7°
N9CBLH20110.2°110.7°
CBGCBKOAX98.4°107.3°
CBGCBKCAP110.1°109.9°
CBKCBGH17110.9°110.5°
CBGCBKH19112.3°109.9°
N3C2H3118.9°118.8°
CBLOAXCBK103.4°107.0°
OAXCBLH20111.4°110.6°
OAXCBKCAP108.9°109.9°
OAXCBKH19114.9°110.0°
CBKCAPNBN113.4°109.5°
CBKCAPH15108.5°109.5°
CBKCAPH16108.5°109.5°
CAPCBKH19111.5°109.9°
CAPNBNCAA103.7°111.0°
CAPNBNCAO116.1°111.0°
NBNCAPH15108.5°109.5°
NBNCAPH16108.5°109.4°
NACCAZNAR120.0°120.8°
NACCAZCBC117.9°120.8°
CAZNACH23109.5°120.1°
CAZNACH24109.5°120.0°
NARCAZCBC122.0°118.4°
CAZNARCAL118.6°121.2°
CAZCBCNAV133.2°134.4°
CAZCBCCBE120.3°118.1°
CAANBNCAO112.5°111.0°
NBNCAAH9109.5°109.5°
NBNCAAH10109.5°109.5°
NBNCAAH11109.5°109.4°
NBNCAOCAI112.2°109.5°
NBNCAOH13108.8°109.5°
NBNCAOH14108.8°109.5°
CBCNAVCBA108.1°109.4°
NAVCBCCBE106.5°107.5°
NAVCBACAJ123.9°125.2°
NAVCBANBP109.6°109.6°
NARCALNAT120.0°122.5°
NARCALH12120.0°118.7°
CBCCBENAT119.6°119.1°
CBCCBENBP109.8°106.2°
O5'C5'C4'109.2°109.5°
O5'C5'H7109.6°109.5°
O5'C5'H8109.6°109.5°
C5'O5'H28109.5°114.0°
CAJCBANBP126.5°125.2°
CBACAJCAI178.1°180.0°
CBANBPCBE105.9°107.4°
CBANBPC1'137.2°126.3°
CAJCAICAO179.3°180.0°
CAICAOH13108.7°109.5°
CAICAOH14108.8°109.4°
CALNATCBE119.5°120.7°
NATCALH12120.0°118.8°
NATCBENBP130.6°134.7°
CBENBPC1'116.7°126.3°
C4'O4'C1'106.7°107.0°
O4'C4'C5'114.3°110.0°
O4'C4'C3'104.5°107.3°
O4'C4'H6112.2°109.9°
O4'C1'NBP103.3°110.8°
O4'C1'C2'99.2°103.5°
O4'C1'H2112.8°110.6°
NBPC1'C2'118.6°110.6°
NBPC1'H2111.6°110.6°
C5'C4'C3'105.2°109.9°
C5'C4'H6110.0°109.8°
C4'C5'H7109.6°109.5°
C4'C5'H8109.5°109.5°
C4'C3'C2'102.0°104.2°
C4'C3'O3'101.5°110.5°
C4'C3'H5112.3°110.6°
C3'C4'H6110.2°109.9°
C1'C2'C3'97.4°102.1°
C1'C2'O2'110.6°110.9°
C2'C1'H2110.5°110.6°
C1'C2'H4111.9°110.9°
C3'C2'O2'110.1°110.9°
C2'C3'O3'112.6°110.5°
C3'C2'H4111.7°110.9°
C2'C3'H5112.2°110.4°
O2'C2'H4113.9°110.9°
C2'O2'H26109.5°114.0°
O3'C3'H5115.0°110.4°
C3'O3'H27109.5°114.0°
H7C5'H8109.5°109.4°
H9CAAH10109.5°109.5°
H9CAAH11109.4°109.5°
H10CAAH11109.5°109.5°
H13CAOH14109.5°109.5°
H15CAPH16109.5°109.5°
H21N6H22109.5°120.0°
H23NACH24109.5°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N6C6C5N70.2°0.0°
N6C6C5N1179.4°180.0°
N6C6C5C4179.9°180.0°
N6C6N1C2179.5°180.0°
C6N6H21H22120.0°180.0°
N7C5C6C4179.7°179.9°
N7C5C6N1179.6°180.0°
C5N7C8N90.0°0.0°
N7C5C4N90.2°0.1°
N7C5C4N3179.6°179.8°
C5N7C8H1180.0°180.0°
C8N7C5C6179.6°180.0°
C8N7C5C40.1°0.1°
N7C8N9H1180.0°180.0°
N7C8N9C40.1°0.0°
N7C8N9CBL179.7°179.8°
C5C6N1C20.1°0.1°
C6C5C4N9179.6°180.0°
C6C5C4N30.1°0.2°
C5C6N6H21179.4°0.0°
C5C6N6H2259.4°180.0°
N1C6C5C40.7°0.1°
C6N1C2N31.3°0.3°
C6N1C2H3178.7°179.9°
N1C6N6H210.0°180.0°
N1C6N6H22120.0°0.0°
C5C4N9C80.2°0.0°
C5C4N9N3179.3°179.7°
C5C4N9CBL179.8°179.7°
C5C4N3C21.5°0.4°
C8N9CBLCBH71.2°94.7°
C8N9C4CBL179.6°179.8°
C8N9C4N3179.5°179.7°
C8N9CBLOAX44.1°19.4°
C8N9CBLH20166.3°142.4°
N1C2N3C42.2°0.4°
N1C2N3H3180.0°179.8°
OAGCBHCBGCBL114.2°118.2°
OAGCBHCBGH18127.0°123.6°
OAGCBHCBLH18127.5°123.6°
OAGCBHCBGOAF30.1°20.3°
OAGCBHCBLN9123.9°86.3°
OAGCBHCBGCBK86.8°139.1°
OAGCBHCBLOAX118.4°155.2°
OAGCBHCBGH17156.9°102.2°
OAGCBHCBLH200.9°36.7°
CBGCBHCBLH18118.8°118.3°
CBHCBGOAFCBK109.1°114.9°
CBHCBGOAFH17125.4°122.6°
CBGCBHCBLN9122.4°155.6°
CBHCBGCBKH17116.0°118.7°
CBGCBHCBLOAX4.7°37.0°
CBHCBGCBKOAX52.4°2.0°
CBHCBGCBKCAP166.2°121.4°
CBHCBGCBKH1968.9°117.6°
CBGCBHCBLH20114.6°81.5°
CBHCBGOAFH29180.0°65.2°
CBGCBHOAGH30180.0°61.5°
CBHCBLN9C4109.2°85.0°
CBLCBHCBGOAF144.3°97.9°
CBHCBLN9OAX115.3°114.1°
CBHCBLN9H20122.5°122.9°
CBLCBHCBGCBK27.4°20.9°
CBHCBLOAXH20117.9°118.5°
CBHCBLOAXCBK39.9°40.0°
CBLCBHCBGH1788.9°139.6°
CBLCBHOAGH3071.6°174.2°
N9C4N3C2179.2°179.9°
C4N9CBLOAX135.5°160.9°
C4N9C8H1179.9°180.0°
C4N9CBLH2013.3°37.9°
N3C4N9CBL0.8°0.0°
C4N3C2H3177.8°179.7°
OAFCBGCBKH17126.7°122.5°
OAFCBGCBKOAX169.7°120.9°
OAFCBGCBKCAP76.5°119.7°
OAFCBGCBHH1896.9°143.9°
OAFCBGCBKH1948.4°1.3°
N9CBLOAXH20121.5°123.0°
N9CBLOAXCBK160.4°158.6°
CBLN9C8H10.3°0.2°
N9CBLCBHH183.6°37.3°
CBGCBKOAXCBL58.4°26.5°
CBGCBKOAXCAP114.7°119.4°
CBGCBKOAXH19119.4°119.5°
CBGCBKCAPH19125.3°121.0°
CBGCBKCAPNBN179.6°175.0°
CBGCBKCAPH1559.0°55.0°
CBGCBKCAPH1659.8°65.0°
CBKCBGCBHH18146.2°97.4°
CBKCBGOAFH2970.9°180.0°
CBLOAXCBKCAP173.1°145.9°
OAXCBLCBHH18114.1°81.3°
CBLOAXCBKH1960.9°93.0°
OAXCBKCAPH19127.8°121.2°
OAXCBKCAPNBN73.5°67.2°
OAXCBKCAPH15165.9°172.8°
OAXCBKCAPH1647.0°52.8°
OAXCBKCBGH1763.6°116.7°
CBKOAXCBLH2078.0°78.4°
CBKCAPNBNH15120.6°120.0°
CBKCAPNBNH16120.6°120.0°
CBKCAPNBNCAA146.9°66.0°
CBKCAPNBNCAO89.1°170.0°
CBKCAPH15H16118.2°120.1°
CAPCBKCBGH1750.2°2.8°
CAPNBNCAACAO126.3°124.0°
CAPNBNCAOCAI71.9°170.0°
CAPNBNCAAH9180.0°59.9°
CAPNBNCAAH1060.0°180.0°
CAPNBNCAAH1160.0°60.0°
CAPNBNCAOH1348.5°70.0°
CAPNBNCAOH14167.7°50.0°
NBNCAPH15H16118.2°119.9°
NBNCAPCBKH1954.3°54.0°
NACCAZNARCBC178.6°179.9°
NACCAZCBCNAV0.0°0.0°
NACCAZNARCAL178.5°179.9°
NACCAZCBCCBE179.6°179.7°
CAZNACH23H24120.0°180.0°
NARCAZCBCNAV178.6°180.0°
NARCAZCBCCBE1.0°0.2°
CAZNARCALNAT3.6°0.0°
CAZNARCALH12176.4°179.7°
NARCAZNACH230.0°0.0°
NARCAZNACH24120.0°180.0°
CAZCBCNAVCBE179.7°179.8°
CAZCBCNAVCBA179.3°180.0°
CBCCAZNARCAL2.9°0.0°
CAZCBCCBENAT0.2°0.6°
CAZCBCCBENBP178.9°180.0°
CBCCAZNACH23178.6°180.0°
CBCCAZNACH2458.6°0.0°
CAANBNCAOCAI168.9°66.0°
NBNCAAH9H10120.0°120.1°
NBNCAAH9H11120.0°119.9°
NBNCAAH10H11120.0°120.0°
CAANBNCAOH1370.8°54.0°
CAANBNCAOH1448.4°174.0°
CAANBNCAPH1592.5°173.9°
CAANBNCAPH1626.4°54.0°
NBNCAOCAICAJ47.1°10.0°
NBNCAOCAIH13120.4°120.0°
NBNCAOCAIH14120.4°120.0°
CAONBNCAAH953.7°176.1°
CAONBNCAAH1066.3°56.0°
CAONBNCAAH11173.7°64.0°
NBNCAOH13H14118.8°120.0°
CAONBNCAPH1531.5°50.0°
CAONBNCAPH16150.3°70.0°
CBCNAVCBACAJ179.4°179.9°
CBCNAVCBANBP2.0°0.2°
NAVCBCCBENAT179.9°179.6°
NAVCBCCBENBP1.4°0.2°
CBANAVCBCCBE0.4°0.3°
NAVCBACAJNBP178.4°179.9°
NAVCBACAJCAI162.9°13.1°
NAVCBANBPCBE2.8°0.0°
NAVCBANBPC1'177.3°180.0°
NARCALNATH12180.0°179.6°
NARCALNATCBE2.5°0.4°
CBCCBENBPCBA2.5°0.1°
CBCCBENATCAL0.6°0.7°
CBCCBENATNBP178.5°179.2°
CBCCBENBPC1'178.4°179.9°
O5'C5'C4'O4'14.1°67.1°
O5'C5'C4'H7120.0°120.0°
O5'C5'C4'H8120.0°120.1°
O5'C5'C4'C3'100.0°175.0°
O5'C5'C4'H6141.4°53.9°
O5'C5'H7H8120.1°120.0°
CBACAJCAICAO45.3°116.8°
CAJCBANBPCBE178.7°180.0°
CAJCBANBPC1'4.1°0.0°
NBPCBACAJCAI15.4°166.8°
CBANBPCBENAT178.9°179.4°
CBANBPCBEC1'175.9°180.0°
CBANBPC1'O4'59.4°39.2°
CBANBPC1'C2'49.0°75.0°
CBANBPC1'H2179.2°162.2°
CAJCAICAOH13167.5°130.0°
CAJCAICAOH1473.3°110.0°
CAICAOH13H14118.7°120.0°
CALNATCBENBP177.9°179.8°
NATCBENBPC1'3.0°0.6°
CBENATCALH12177.5°180.0°
CBENBPC1'O4'114.8°140.8°
CBENBPC1'C2'136.8°105.0°
CBENBPC1'H26.7°17.8°
C4'O4'C1'NBP174.8°158.6°
O4'C4'C5'C3'114.1°117.9°
O4'C4'C5'H6127.2°121.0°
O4'C4'C3'H6120.8°119.5°
C4'O4'C1'C2'52.4°40.0°
O4'C4'C3'C2'5.1°2.0°
O4'C4'C3'O3'111.3°120.7°
C4'O4'C1'H264.5°78.4°
O4'C4'C3'H5125.4°116.7°
O4'C4'C5'H7134.1°172.9°
O4'C4'C5'H8105.8°53.0°
O4'C1'NBPC2'108.4°114.2°
O4'C1'NBPH2121.5°123.0°
C1'O4'C4'C5'144.3°146.0°
C1'O4'C4'C3'29.8°26.5°
O4'C1'C2'H2118.7°118.5°
O4'C1'C2'C3'51.7°37.0°
O4'C1'C2'O2'166.5°155.2°
O4'C1'C2'H465.3°81.2°
C1'O4'C4'H689.6°93.0°
NBPC1'C2'H2130.6°122.8°
NBPC1'C2'C3'162.4°155.7°
NBPC1'C2'O2'82.8°86.1°
NBPC1'C2'H445.4°37.5°
C5'C4'C3'H6118.5°121.0°
C5'C4'C3'C2'115.7°121.6°
C5'C4'C3'O3'128.0°119.7°
C5'C4'C3'H54.6°2.9°
C4'C5'H7H8120.1°120.0°
C4'C5'O5'H28180.0°180.0°
C4'C3'C2'C1'33.4°20.9°
C4'C3'C2'O3'108.0°118.7°
C4'C3'C2'H5120.4°118.8°
C4'C3'C2'O2'148.5°139.1°
C4'C3'O3'H5121.5°122.7°
C4'C3'C2'H483.8°97.3°
C3'C4'C5'H720.0°55.0°
C3'C4'C5'H8140.1°64.9°
C4'C3'O3'H27180.0°65.2°
C1'C2'C3'O2'115.1°118.2°
C1'C2'C3'H4117.2°118.1°
C1'C2'O2'H4127.1°123.6°
C1'C2'C3'O3'74.6°97.8°
C1'C2'C3'H5153.8°139.7°
C1'C2'O2'H26180.0°180.0°
C3'C2'O2'H4126.4°123.7°
C2'C3'O3'H5130.2°122.5°
C3'C2'C1'H267.0°81.5°
C2'C3'C4'H6125.8°117.4°
C3'C2'O2'H2673.5°67.3°
C2'C3'O3'H2771.7°180.0°
O2'C2'C3'O3'40.5°20.4°
O2'C2'C1'H247.8°36.7°
O2'C2'C3'H591.1°102.1°
O3'C3'C2'H4168.2°144.0°
O3'C3'C4'H69.5°1.3°
H2C1'C2'H4176.0°160.3°
H4C2'C3'H536.6°21.5°
H4C2'O2'H2652.9°56.4°
H5C3'C4'H6113.9°123.9°
H5C3'O3'H2758.5°57.5°
H6C4'C5'H798.7°66.1°
H6C4'C5'H821.4°174.0°
H7C5'O5'H2860.0°60.0°
H8C5'O5'H2860.1°59.9°
H9CAAH10H11119.9°120.0°
H15CAPCBKH1966.3°66.0°
H16CAPCBKH19174.9°174.0°
H17CBGCBHH1829.9°21.3°
H17CBGCBKH19175.1°123.8°
H17CBGOAFH2954.6°57.4°
H18CBHCBLH20126.6°160.3°
H18CBHOAGH3054.4°62.1°

222624

PDB entries from 2024-07-17

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