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DWN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O41C41doub1.22Å1.25Å
C41N31sing1.35Å1.35Å
C41C51sing1.42Å1.49Å
C5AC51sing1.51Å1.51Å
N31C21sing1.35Å1.35Å
C51C61doub1.35Å1.39Å
C21O21doub1.22Å1.25Å
C21N11sing1.35Å1.34Å
C61N11sing1.37Å1.35Å
N11C1Xsing1.46Å1.47Å
O2PPdoub1.48Å1.49Å
O4XC1Xsing1.44Å1.42Å
O4XC4Xsing1.44Å1.43Å
C1XC2Xsing1.54Å1.52Å
C5XC4Xsing1.53Å1.52Å
C5XO5Xsing1.43Å1.43Å
O1PPsing1.61Å1.51Å
PO5Xsing1.61Å1.60Å
POPPsing1.61Å1.62Å
C4XC3Xsing1.54Å1.52Å
C2XC3Xsing1.55Å1.51Å
O4PP2doub1.48Å1.51Å
OPPP2sing1.61Å1.60Å
C3XO3Xsing1.43Å1.44Å
P2O3Psing1.61Å1.52Å
P2O1sing1.61Å1.61Å
C6C5sing1.53Å1.53Å
O1C1sing1.43Å1.42Å
C5O5sing1.43Å1.41Å
C5C4sing1.51Å1.50Å
O5C1sing1.43Å1.43Å
O4C4doub1.21Å1.24Å
C1C2sing1.53Å1.53Å
C4C3sing1.52Å1.50Å
C2C3sing1.53Å1.52Å
C3N3sing1.47Å1.45Å
C5H1sing1.09Å1.10Å
C6H2sing1.09Å1.10Å
C6H3sing1.09Å1.10Å
C6H4sing1.09Å1.10Å
C3H5sing1.09Å1.10Å
N3H6sing1.01Å1.00Å
N3H7sing1.01Å1.00Å
C2H9sing1.09Å1.10Å
C2H10sing1.09Å1.10Å
C1H11sing1.09Å1.10Å
O3PH12sing0.97Å0.95Å
O1PH13sing0.97Å0.95Å
C5XH14sing1.09Å1.10Å
C5XH15sing1.09Å1.10Å
C4XH16sing1.09Å1.10Å
C3XH17sing1.09Å1.10Å
O3XH18sing0.97Å0.95Å
C2XH19sing1.09Å1.10Å
C2XH20sing1.09Å1.10Å
C1XH21sing1.09Å1.10Å
N31H22sing0.97Å1.00Å
C61H23sing1.08Å1.08Å
C5AH24sing1.09Å1.10Å
C5AH25sing1.09Å1.10Å
C5AH26sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O41C41N31119.6°120.3°
O41C41C51121.3°120.3°
N31C41C51118.8°119.4°
C41N31C21120.6°120.3°
C41N31H22119.7°119.9°
C41C51C5A121.5°120.4°
C41C51C61116.4°119.1°
C5AC51C61122.1°120.5°
C51C5AH24109.5°109.5°
C51C5AH25109.4°109.5°
C51C5AH26109.4°109.4°
N31C21O21118.0°119.5°
N31C21N11121.0°120.9°
C21N31H22119.7°119.9°
C51C61N11120.6°119.7°
C51C61H23119.7°120.2°
O21C21N11120.8°119.5°
C21N11C61122.1°120.6°
C21N11C1X117.8°119.7°
C61N11C1X119.9°119.7°
N11C61H23119.7°120.1°
N11C1XO4X108.7°110.4°
N11C1XC2X108.2°110.4°
N11C1XH21112.0°110.4°
O2PPO1P116.3°109.4°
O2PPO5X112.4°109.4°
O2PPOPP110.1°109.5°
C1XO4XC4X112.2°105.3°
O4XC1XC2X103.3°104.8°
O4XC1XH21112.9°110.4°
O4XC4XC5X103.3°110.4°
O4XC4XC3X107.8°104.8°
O4XC4XH16112.5°110.4°
C1XC2XC3X106.7°104.0°
C1XC2XH19110.2°110.5°
C1XC2XH20110.2°110.6°
C2XC1XH21111.3°110.4°
C4XC5XO5X106.2°109.5°
C5XC4XC3X110.8°110.4°
C4XC5XH14110.3°109.4°
C4XC5XH15110.3°109.5°
C5XC4XH16111.0°110.3°
C5XO5XP116.7°123.0°
O5XC5XH14110.3°109.5°
O5XC5XH15110.3°109.5°
O1PPO5X111.8°109.5°
O1PPOPP104.5°109.5°
PO1PH13109.5°114.0°
O5XPOPP100.1°109.5°
POPPP2134.1°134.0°
C4XC3XC2X101.6°104.1°
C4XC3XO3X106.7°110.5°
C3XC4XH16111.0°110.4°
C4XC3XH17112.0°110.5°
C2XC3XO3X110.4°110.5°
C2XC3XH17112.2°110.6°
C3XC2XH19110.2°110.5°
C3XC2XH20110.2°110.5°
O4PP2OPP110.0°109.5°
O4PP2O3P120.3°109.5°
O4PP2O1107.7°109.5°
OPPP2O3P108.3°109.5°
OPPP2O1102.3°109.4°
O3XC3XH17113.3°110.5°
C3XO3XH18109.5°114.0°
O3PP2O1106.7°109.5°
P2O3PH12109.5°114.0°
P2O1C1118.5°123.0°
C6C5O5101.3°109.7°
C6C5C4115.2°109.7°
C6C5H1108.4°109.7°
C5C6H2109.5°109.4°
C5C6H3109.5°109.5°
C5C6H4109.4°109.4°
O1C1O5109.3°109.4°
O1C1C2107.7°109.5°
O1C1H11109.6°109.3°
O5C5C4113.0°108.4°
C5O5C1114.1°114.0°
O5C5H1110.0°109.7°
C5C4O4118.7°121.1°
C5C4C3116.6°117.7°
C4C5H1108.7°109.7°
O5C1C2112.6°110.0°
O5C1H11109.5°109.4°
O4C4C3124.6°121.1°
C1C2C3109.8°109.0°
C1C2H9109.4°109.7°
C1C2H10109.4°109.6°
C2C1H11108.2°109.2°
C4C3C2117.7°108.0°
C4C3N3108.6°109.7°
C4C3H5104.5°109.7°
C2C3N3115.2°109.8°
C2C3H5104.3°109.8°
C3C2H9109.4°109.5°
C3C2H10109.4°109.5°
N3C3H5105.1°109.7°
C3N3H6109.5°111.0°
C3N3H7109.5°110.9°
H2C6H3109.5°109.5°
H2C6H4109.5°109.4°
H3C6H4109.5°109.5°
H6N3H7109.5°111.0°
H9C2H10109.5°109.5°
H14C5XH15109.5°109.5°
H19C2XH20109.5°110.5°
H24C5AH25109.5°109.5°
H24C5AH26109.5°109.5°
H25C5AH26109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O41C41N31C51175.1°179.6°
O41C41C51C5A2.6°0.1°
O41C41N31C21177.5°180.0°
O41C41C51C61178.9°180.0°
O41C41N31H222.5°0.1°
N31C41C51C5A177.7°179.7°
C41N31C21H22180.0°179.9°
N31C41C51C613.8°0.3°
C41N31C21O21177.4°180.0°
C41N31C21N118.4°0.1°
C41C51C5AC61178.4°179.9°
C51C41N31C217.4°0.3°
C41C51C61N111.2°0.0°
C51C41N31H22172.6°179.8°
C41C51C61H23178.7°179.9°
C41C51C5AH24180.0°90.0°
C41C51C5AH2560.0°30.0°
C41C51C5AH2660.0°150.0°
C5AC51C61N11179.7°180.0°
C5AC51C61H230.3°0.1°
C51C5AH24H25120.0°120.0°
C51C5AH24H26120.0°119.9°
C51C5AH25H26119.9°120.0°
N31C21O21N11174.2°180.0°
N31C21N11C615.6°0.2°
N31C21N11C1X177.8°180.0°
C51C61N11C212.1°0.2°
C51C61N11H23180.0°179.9°
C51C61N11C1X178.6°180.0°
C61C51C5AH241.6°89.9°
C61C51C5AH25118.4°150.0°
C61C51C5AH26121.6°30.0°
O21C21N11C61179.7°179.7°
O21C21N11C1X3.7°0.0°
O21C21N31H222.6°0.1°
C21N11C61C1X176.5°179.7°
C21N11C1XO4X125.5°53.6°
C21N11C1XC2X123.0°61.8°
C21N11C1XH210.1°175.9°
N11C21N31H22171.6°180.0°
C21N11C61H23177.8°179.7°
C61N11C1XO4X57.8°126.7°
C61N11C1XC2X53.7°117.9°
C61N11C1XH21176.7°4.4°
N11C1XO4XC2X114.8°118.9°
N11C1XO4XH21124.9°122.3°
N11C1XO4XC4X132.4°159.3°
N11C1XC2XH21123.5°122.3°
N11C1XC2XC3X143.5°142.8°
N11C1XC2XH1996.9°24.2°
N11C1XC2XH2024.0°98.5°
C1XN11C61H231.3°0.1°
O2PPO5XC5X63.7°55.0°
O2PPO1PO5X131.0°120.0°
O2PPO1POPP121.6°120.0°
O2PPO5XOPP116.8°120.0°
O2PPOPPP260.1°40.0°
O2PPO1PH130.0°180.0°
O4XC1XC2XH21121.4°118.8°
C1XO4XC4XC5X117.7°159.3°
C1XO4XC4XC3X0.3°40.5°
O4XC1XC2XC3X28.4°24.0°
C1XO4XC4XH16122.4°78.4°
O4XC1XC2XH19148.0°94.7°
O4XC1XC2XH2091.1°142.7°
C4XO4XC1XC2X17.7°40.5°
O4XC4XC5XC3X115.3°115.4°
O4XC4XC5XH16120.9°122.3°
O4XC4XC5XO5X169.0°69.5°
O4XC4XC3XH16123.7°118.9°
O4XC4XC3XC2X17.1°24.0°
O4XC4XC3XO3X98.5°142.6°
O4XC4XC5XH1471.5°50.4°
O4XC4XC5XH1549.5°170.4°
O4XC4XC3XH17137.0°94.8°
C4XO4XC1XH21102.6°78.3°
C1XC2XC3XC4X27.6°0.0°
C1XC2XC3XH19119.6°118.7°
C1XC2XC3XH20119.6°118.8°
C1XC2XC3XO3X85.2°118.7°
C1XC2XC3XH17147.4°118.7°
C1XC2XH19H20121.3°122.8°
C4XC5XO5XH14119.5°119.9°
C4XC5XO5XH15119.5°120.1°
C4XC5XO5XP175.1°180.0°
C5XC4XC3XH16123.9°122.2°
C5XC4XC3XC2X95.3°142.9°
C5XC4XC3XO3X149.0°98.5°
C4XC5XH14H15121.5°120.0°
C5XC4XC3XH1724.6°24.1°
C5XO5XPO1P69.2°64.9°
C5XO5XPOPP179.5°175.1°
O5XC5XC4XC3X75.7°175.0°
O5XC5XH14H15121.5°120.1°
O5XC5XC4XH1648.1°52.8°
O1PPO5XOPP110.2°120.0°
O1PPOPPP2174.2°80.0°
O5XPOPPP258.4°160.0°
O5XPO1PH13131.0°60.0°
PO5XC5XH1465.4°60.1°
PO5XC5XH1555.7°60.0°
POPPP2O4P59.1°40.0°
POPPP2O3P74.3°80.0°
POPPP2O1173.3°160.0°
OPPPO1PH13121.6°60.0°
C4XC3XC2XO3X112.9°118.7°
C4XC3XC2XH17119.7°118.7°
C4XC3XO3XH17123.7°122.6°
C3XC4XC5XH1443.8°65.0°
C3XC4XC5XH15164.8°55.0°
C4XC3XO3XH18180.0°180.0°
C4XC3XC2XH19147.2°118.7°
C4XC3XC2XH2091.9°118.8°
C2XC3XO3XH17126.8°122.7°
C2XC3XC4XH16140.8°95.0°
C2XC3XO3XH1870.4°65.3°
C3XC2XH19H20121.3°122.6°
C3XC2XC1XH2193.0°94.9°
O4PP2OPPO3P133.3°120.0°
O4PP2OPPO1114.2°120.0°
O4PP2O3PO1122.9°120.0°
O4PP2O1C1172.7°55.0°
O4PP2O3PH120.0°180.0°
OPPP2O3PO1109.5°119.9°
OPPP2O1C156.8°175.0°
OPPP2O3PH12127.6°59.9°
O3XC3XC4XH1625.2°23.7°
O3XC3XC2XH1934.3°122.7°
O3XC3XC2XH20155.2°0.1°
O3PP2O1C156.8°65.0°
P2O1C1O593.7°90.0°
P2O1C1C2143.8°149.3°
P2O1C1H1126.3°29.8°
O1P2O3PH12122.9°60.0°
C6C5O5C4123.8°119.8°
C6C5O5H1114.5°120.6°
C6C5C4H1121.9°120.5°
C6C5O5C1166.0°64.1°
C6C5C4O470.5°108.9°
C6C5C4C3106.6°70.9°
C5C6H2H3120.0°120.0°
C5C6H2H4120.0°119.9°
C5C6H3H4120.0°120.0°
O1C1O5C551.4°175.1°
O1C1O5C2119.6°120.4°
O1C1O5H11120.1°119.7°
O1C1C2H11118.4°119.6°
O1C1C2C384.2°178.6°
O1C1C2H935.9°58.7°
O1C1C2H10155.8°61.6°
O5C5C4H1122.4°119.7°
O5C5C4O4173.8°131.3°
C5O5C1C268.1°64.6°
O5C5C4C39.2°48.9°
O5C5C6H2180.0°60.0°
O5C5C6H360.0°180.0°
O5C5C6H460.0°60.0°
C5O5C1H11171.5°55.3°
C4C5O5C142.2°55.6°
C5C4O4C3176.8°179.7°
C5C4C3C236.8°48.7°
C5C4C3N3170.0°168.4°
C4C5C6H257.8°178.9°
C4C5C6H362.3°61.1°
C4C5C6H4177.8°59.0°
C5C4C3H578.3°71.0°
O5C1C2H11121.1°120.1°
O5C1C2C336.3°61.1°
C1O5C5H179.5°175.3°
O5C1C2H9156.4°179.0°
O5C1C2H1083.7°58.7°
O4C4C3C2146.3°131.6°
O4C4C3N313.2°11.9°
O4C4C5H151.4°11.7°
O4C4C3H598.6°108.8°
C1C2C3C412.9°51.8°
C1C2C3H9120.1°120.0°
C1C2C3H10120.1°119.9°
C1C2C3N3143.0°171.4°
C1C2C3H5102.3°67.8°
C1C2H9H10119.8°120.3°
C4C3C2N3130.1°119.6°
C4C3C2H5115.2°119.6°
C4C3N3H5111.4°120.7°
C3C4C5H1131.5°168.6°
C4C3N3H6180.0°59.9°
C4C3N3H760.0°64.0°
C4C3C2H9107.1°171.8°
C4C3C2H10133.0°68.1°
C2C3N3H5114.2°120.8°
C2C3N3H645.6°178.5°
C2C3N3H7165.6°54.6°
C3C2H9H10119.8°120.1°
C3C2C1H11157.5°59.0°
C3N3H6H7120.0°123.9°
N3C3C2H923.0°68.5°
N3C3C2H1096.9°51.5°
H1C5C6H264.3°60.6°
H1C5C6H3175.7°59.4°
H1C5C6H455.7°179.5°
H2C6H3H4120.0°120.0°
H5C3N3H668.6°60.7°
H5C3N3H751.4°175.4°
H5C3C2H9137.6°52.2°
H5C3C2H1017.8°172.3°
H9C2C1H1182.5°61.0°
H10C2C1H1137.4°178.8°
H14C5XC4XH16167.7°172.7°
H15C5XC4XH1671.3°67.3°
H16C4XC3XH1799.3°146.3°
H17C3XO3XH1856.4°57.4°
H17C3XC2XH1993.1°0.1°
H17C3XC2XH2027.8°122.5°
H19C2XC1XH2126.6°146.5°
H20C2XC1XH21147.5°23.8°
H24C5AH25H26120.0°120.0°

222415

PDB entries from 2024-07-10

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