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SummaryGeometryRelated PDB entries

A1AQN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C02O01sing1.43Å1.39Å
C03C02sing1.53Å1.48Å
C04C03sing1.54Å1.32Å
P06O05sing1.61Å1.62Å
O07P06doub1.48Å1.42Å
S08P06sing2.12Å2.11Å
O09P06sing1.61Å1.44Å
O05C04sing1.43Å1.36Å
C10C04sing1.55Å1.47Å
O11C10sing1.43Å1.35Å
C12C10sing1.54Å1.58Å
C14N13sing1.36Å1.29ÅAromatic
N15C14doub1.30Å1.28ÅAromatic
C16N15sing1.36Å1.30ÅAromatic
C17C16doub1.40Å1.38ÅAromatic
N18C17sing1.38Å1.42Å
N19C17sing1.33Å1.30ÅAromatic
C20N19doub1.32Å1.30ÅAromatic
N21C20sing1.32Å1.30ÅAromatic
C22N21doub1.33Å1.29ÅAromatic
N13C12sing1.46Å1.43Å
O23C12sing1.44Å1.26Å
C03O23sing1.44Å1.58Å
N13C22sing1.37Å1.29ÅAromatic
C16C22sing1.41Å1.35ÅAromatic
C02H022sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C04H041sing1.09Å1.10Å
C10H101sing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C14H141sing1.08Å1.08Å
C20H201sing1.08Å1.08Å
N18H181sing0.97Å1.00Å
N18H182sing0.97Å1.00Å
O01H011sing0.97Å0.95Å
O09H1sing0.97Å0.95Å
O11H111sing0.97Å0.95Å
S08H2sing1.35Å1.30Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O01C02C0396.9°109.5°
O01C02H022112.5°109.5°
O01C02H021112.5°109.5°
C02O01H011109.5°114.0°
C02C03C04121.2°110.4°
C02C03O23110.5°110.4°
C03C02H022112.5°109.5°
C03C02H021112.5°109.4°
C02C03H031102.9°110.3°
C03C04O05122.8°110.5°
C03C04C1087.9°104.0°
C04C03O23113.0°104.9°
C04C03H031104.5°110.5°
C03C04H041112.5°110.5°
O05P06O07114.7°109.4°
O05P06S08110.7°109.5°
O05P06O09107.4°109.5°
P06O05C04123.2°123.0°
O07P06S08114.9°109.4°
O07P06O09104.6°109.5°
S08P06O09103.4°109.5°
P06S08H2102.0°103.0°
P06O09H1109.5°114.0°
O05C04C10108.6°110.6°
O05C04H041111.9°110.5°
C04C10O11111.2°110.5°
C04C10C12105.3°104.1°
C10C04H041110.0°110.5°
C04C10H101108.3°110.6°
O11C10C12114.6°110.6°
O11C10H101110.0°110.4°
C10O11H111109.5°114.0°
C10C12N13117.2°110.4°
C10C12O23102.9°104.8°
C12C10H101107.1°110.5°
C10C12H121108.9°110.4°
N13C14N15111.7°110.0°
C14N13C12126.1°126.3°
C14N13C22107.3°107.5°
N13C14H141124.2°125.0°
C14N15C16106.0°109.4°
N15C14H141124.1°125.0°
N15C16C17134.7°134.7°
N15C16C22108.5°107.1°
C16C17N18119.4°120.8°
C16C17N19119.9°118.5°
C17C16C22116.8°118.2°
N18C17N19120.7°120.8°
C17N18H181109.5°120.0°
C17N18H182109.4°120.0°
C17N19C20120.0°121.2°
N19C20N21122.4°122.5°
N19C20H201118.8°118.7°
C20N21C22120.1°120.6°
N21C20H201118.8°118.8°
N21C22N13133.0°134.9°
N21C22C16120.7°119.1°
N13C12O23102.9°110.4°
C12N13C22125.8°126.3°
N13C12H121110.9°110.3°
C12O23C03101.5°105.2°
O23C12H121113.8°110.3°
O23C03H031102.1°110.3°
N13C22C16106.4°106.0°
H022C02H021109.5°109.5°
H181N18H182109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O01C02C03H022117.9°120.0°
O01C02C03H021117.9°120.0°
O01C02C03C04132.7°178.2°
O01C02C03O2391.8°66.4°
O01C02H022H021125.9°120.0°
O01C02C03H03116.6°55.8°
C02C03C04O23134.5°118.9°
C02C03C04H031115.3°122.3°
C02C03C04O0571.6°24.1°
C02C03C04C10177.5°142.8°
C02C03O23C12167.9°159.3°
C02C03O23H031108.9°122.2°
C03C02H022H021125.9°120.0°
C02C03C04H04166.7°98.5°
C03C02O01H011180.0°180.0°
C03C04O05P06144.5°121.5°
C03C04O05C1099.9°114.7°
C03C04O05H041138.5°122.6°
C03C04C10H041113.2°118.6°
C03C04C10O11175.3°118.8°
C03C04C10C1250.5°0.0°
C04C03O23C1228.4°40.5°
C04C03O23H031111.6°119.0°
C04C03C02H02214.8°61.9°
C04C03C02H021109.4°58.2°
C03C04C10H10163.7°118.7°
O05P06O07S08129.9°120.0°
O05P06O07O09117.4°120.0°
O05P06S08O09114.8°120.0°
P06O05C04C10115.7°123.8°
P06O05C04H0416.0°1.1°
O05P06O09H1122.3°60.0°
O05P06S08H2180.0°179.9°
O07P06S08O09113.3°120.0°
O07P06O05C0455.2°54.9°
O07P06O09H10.0°180.0°
O07P06S08H248.1°60.0°
S08P06O05C0476.7°65.0°
S08P06O09H1120.6°60.0°
O09P06O05C04171.1°175.0°
O09P06S08H265.2°60.0°
O05C04C10H041122.8°122.7°
O05C04C10O1151.2°0.1°
O05C04C10C1273.5°118.7°
O05C04C03O2362.9°94.8°
O05C04C03H031173.1°146.3°
O05C04C10H101172.2°122.7°
C04C10O11C12119.3°114.7°
C04C10O11H101120.0°122.6°
C04C10C12H101115.1°118.7°
C04C10C12N13151.4°95.0°
C04C10C12O2339.4°24.0°
C10C04C03O2347.9°24.0°
C10C04C03H03162.2°94.9°
C04C10C12H12181.7°142.8°
C04C10O11H111180.0°180.0°
O11C10C12H101122.4°122.6°
O11C10C12N1386.0°146.3°
O11C10C12O23161.9°94.7°
O11C10C04H04171.5°122.6°
O11C10C12H12140.8°24.1°
C10C12N13C14104.3°99.9°
C10C12N13O23112.1°115.5°
C10C12N13H121125.8°122.3°
C10C12O23H121117.6°118.8°
C10C12O23C038.3°40.5°
C10C12N13C2264.4°80.0°
C12C10C04H041163.8°118.6°
C12C10O11H11160.7°65.3°
N13C14N15H141180.0°179.7°
N13C14N15C162.5°0.1°
C14N13C22N21177.1°180.0°
C14N13C12C22168.7°179.9°
C14N13C12O23143.7°15.6°
C14N13C22C162.6°0.4°
C14N13C12H12121.5°137.8°
C14N15C16C17179.3°180.0°
N15C14N13C12173.7°179.8°
N15C14N13C223.3°0.3°
C14N15C16C220.8°0.2°
N15C16C17C22179.9°179.8°
N15C16C17N180.6°0.0°
N15C16C17N19180.0°179.9°
N15C16C22N21178.6°180.0°
N15C16C22N131.2°0.3°
C16N15C14H141177.5°179.7°
C16C17N18N19179.3°180.0°
C16C17N19C200.7°0.0°
C17C16C22N211.5°0.1°
C17C16C22N13178.7°179.8°
C16C17N18H181179.4°0.0°
C16C17N18H18259.3°180.0°
N18C17N19C20178.7°180.0°
N18C17C16C22179.5°179.8°
C17N18H181H182120.0°180.0°
C17N19C20N210.3°0.4°
N19C17C16C220.2°0.2°
C17N19C20H201179.7°180.0°
N19C17N18H1810.0°180.0°
N19C17N18H182120.0°0.0°
N19C20N21H201180.0°179.6°
N19C20N21C221.1°0.5°
C20N21C22N13178.4°179.3°
C20N21C22C161.9°0.3°
N21C22N13C126.7°0.1°
N21C22N13C16179.7°179.6°
C22N21C20H201179.0°179.9°
N13C12O23H121120.1°122.3°
N13C12O23C03130.6°78.4°
C12N13C22C16173.1°179.7°
N13C12C10H10136.3°23.7°
C12N13C14H1416.3°0.1°
O23C12N13C2247.7°164.5°
C12O23C03H03183.2°78.5°
O23C12C10H10175.8°142.7°
O23C03C02H022150.3°53.6°
O23C03C02H02126.1°173.6°
O23C03C04H041158.8°142.6°
C03O23C12H121109.3°159.3°
C22N13C12H121169.8°42.3°
C22N13C14H141176.7°180.0°
H022C02C03H031101.3°175.8°
H022C02O01H01162.1°60.0°
H021C02C03H031134.5°64.2°
H021C02O01H01162.1°60.0°
H031C03C04H04148.6°23.7°
H041C04C10H10149.5°0.0°
H101C10C12H121163.2°98.5°
H101C10O11H11160.0°57.3°

224572

PDB entries from 2024-09-04

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