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N9P

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NZCE1doub1.32Å1.36ÅAromatic
NZCE2sing1.32Å1.38ÅAromatic
CE1CD1sing1.38Å1.42ÅAromatic
CE2CD2doub1.38Å1.41ÅAromatic
CD1CGdoub1.39Å1.39ÅAromatic
CD2CGsing1.39Å1.40ÅAromatic
CGCBsing1.51Å1.52Å
NCAsing1.47Å1.49Å
CBCAsing1.53Å1.53Å
CACsing1.51Å1.60Å
COdoub1.21Å1.28Å
COXTsing1.34Å1.33Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CAHAsing1.09Å1.10Å
CBH5sing1.09Å1.10Å
CBH6sing1.09Å1.10Å
CD1H7sing1.08Å1.08Å
CD2H8sing1.08Å1.08Å
CE1H9sing1.08Å1.08Å
CE2H10sing1.08Å1.08Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CE1NZCE2120.2°121.8°
NZCE1CD1120.2°120.7°
NZCE1H9119.9°119.6°
NZCE2CD2120.5°120.7°
NZCE2H10119.7°119.7°
CE1CD1CG120.2°119.2°
CE1CD1H7119.9°120.4°
CD1CE1H9119.9°119.6°
CE2CD2CG120.0°119.2°
CE2CD2H8120.0°120.4°
CD2CE2H10119.7°119.6°
CD1CGCD2118.9°118.4°
CD1CGCB121.0°120.8°
CGCD1H7119.9°120.4°
CD2CGCB120.1°120.8°
CGCD2H8120.0°120.4°
CGCBCA110.7°109.4°
CGCBH5109.2°109.4°
CGCBH6109.2°109.5°
NCACB113.2°109.5°
NCAC105.2°109.5°
CANH109.5°111.0°
CANH2109.5°111.0°
NCAHA109.7°109.5°
CBCAC111.1°109.5°
CBCAHA109.2°109.5°
CACBH5109.2°109.5°
CACBH6109.2°109.5°
CACO118.4°119.9°
CACOXT117.7°120.0°
CCAHA108.2°109.5°
OCOXT124.0°120.1°
COXTHXT109.5°117.0°
HNH2109.4°111.0°
H5CBH6109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NZCE1CD1H9180.0°180.0°
CE1NZCE2CD20.6°0.3°
NZCE1CD1CG0.0°0.0°
NZCE1CD1H7180.0°180.0°
CE1NZCE2H10179.3°179.7°
CE2NZCE1CD10.4°0.3°
NZCE2CD2H10180.0°179.9°
NZCE2CD2CG0.4°0.0°
NZCE2CD2H8179.6°180.0°
CE2NZCE1H9179.6°179.7°
CE1CD1CGH7180.0°180.0°
CE1CD1CGCD20.3°0.3°
CE1CD1CGCB179.4°180.0°
CE2CD2CGCD10.1°0.3°
CE2CD2CGH8180.0°179.9°
CE2CD2CGCB179.2°180.0°
CD1CGCD2CB179.1°179.7°
CD1CGCBCA145.8°90.0°
CD1CGCBH594.0°30.0°
CD1CGCBH625.6°150.0°
CD1CGCD2H8179.9°179.7°
CGCD1CE1H9180.0°180.0°
CD2CGCBCA33.3°90.3°
CD2CGCBH586.9°149.7°
CD2CGCBH6153.5°29.7°
CD2CGCD1H7179.7°179.7°
CGCD2CE2H10179.6°179.9°
CGCBCAN50.8°65.0°
CGCBCAH5120.2°119.9°
CGCBCAH6120.2°120.0°
CGCBCAC168.9°175.0°
CGCBCAHA71.8°55.0°
CGCBH5H6119.4°120.0°
CBCGCD1H70.6°0.0°
CBCGCD2H80.8°0.0°
NCACBC118.2°120.0°
NCACBHA122.5°120.0°
NCACHA117.2°120.0°
NCACO135.4°20.0°
NCACOXT45.4°160.0°
CANHH2120.0°124.0°
NCACBH5171.0°55.0°
NCACBH669.4°175.0°
CBCACHA119.9°120.0°
CBCACO101.7°100.0°
CBCACOXT77.4°80.0°
CBCANH180.0°176.0°
CBCANH260.0°60.0°
CACBH5H6119.4°120.0°
CACOOXT179.1°180.0°
CCANH58.5°64.0°
CCANH261.5°60.0°
CCACBH570.9°65.0°
CCACBH648.7°55.0°
CACOXTHXT179.1°180.0°
OCCAHA18.2°140.0°
OCOXTHXT0.0°0.0°
OXTCCAHA162.7°40.0°
HNCAHA57.8°56.0°
H2NCAHA177.8°180.0°
HACACBH548.5°175.0°
HACACBH6168.1°65.0°
H7CD1CE1H90.0°0.0°
H8CD2CE2H100.4°0.0°

224931

PDB entries from 2024-09-11

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