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SummaryGeometryRelated PDB entries

9JC

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
OCdoub1.21Å1.19Å
N5C93sing1.47Å1.45Å
CCAsing1.48Å1.55Å
C95CAdoub1.40Å1.42ÅAromatic
C95C94sing1.36Å1.41ÅAromatic
C93C94sing1.51Å1.54Å
CAN4sing1.32Å1.33ÅAromatic
C94C98doub1.41Å1.44ÅAromatic
N4C99doub1.33Å1.38ÅAromatic
C98C99sing1.42Å1.37ÅAromatic
C98C97sing1.40Å1.43ÅAromatic
C99C100sing1.42Å1.42ÅAromatic
C97C102doub1.36Å1.40ÅAromatic
C100Nsing1.39Å1.48Å
C100C101doub1.38Å1.40ÅAromatic
C102C101sing1.39Å1.41ÅAromatic
C93H6sing1.09Å1.10Å
C93H3sing1.09Å1.10Å
C95H4sing1.08Å1.08Å
C97H5sing1.08Å1.08Å
NHsing0.97Å1.00Å
NH2sing0.97Å1.00Å
N5H8sing1.01Å1.00Å
N5H9sing1.01Å1.00Å
C101H11sing1.08Å1.08Å
C102H12sing1.08Å1.08Å
COXTsing1.35Å33.90Å
OXTHXTsing0.97Å0.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
OCCA121.0°120.0°
OCOXT30.0°120.0°
N5C93C94109.4°109.5°
N5C93H6109.5°109.5°
N5C93H3109.5°109.5°
C93N5H8109.5°111.0°
C93N5H9109.5°111.0°
CCAC95120.6°119.3°
CCAN4118.3°119.2°
CACOXT91.6°120.0°
CAC95C94119.1°119.8°
C95CAN4121.1°121.5°
CAC95H4120.4°120.1°
C95C94C93120.6°120.9°
C95C94C98118.2°118.2°
C94C95H4120.4°120.1°
C93C94C98121.2°120.9°
C94C93H6109.5°109.4°
C94C93H3109.5°109.4°
CAN4C99121.2°121.3°
C94C98C99119.0°119.1°
C94C98C97121.4°121.2°
N4C99C98121.4°120.1°
N4C99C100118.0°121.0°
C99C98C97119.6°119.7°
C98C99C100120.6°119.0°
C98C97C102120.0°120.0°
C98C97H5120.0°120.0°
C99C100N116.5°120.3°
C99C100C101120.0°119.4°
C97C102C101120.1°121.1°
C102C97H5120.0°120.0°
C97C102H12119.9°119.5°
NC100C101123.4°120.3°
C100NH109.5°120.0°
C100NH2109.5°120.0°
C100C101C102119.7°120.8°
C100C101H11120.2°119.5°
C102C101H11120.1°119.6°
C101C102H12119.9°119.4°
H6C93H3109.4°109.5°
HNH2109.5°120.0°
H8N5H9109.5°111.0°
COXTHXT90.0°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
OCCAOXT5.8°179.7°
OCCAC9523.8°0.3°
OCCAN4157.8°179.7°
OCOXTHXT90.0°0.3°
N5C93C94C9515.3°99.7°
N5C93C94H6120.0°120.1°
N5C93C94H3120.0°120.0°
N5C93C94C98164.3°80.0°
N5C93H6H3120.0°120.0°
C93N5H8H9120.0°124.0°
CCAC95N4178.4°180.0°
CCAC95C94178.7°180.0°
CCAN4C99179.2°179.7°
CCAC95H41.3°0.0°
CACOXTHXT90.0°180.0°
CAC95C94H4180.0°179.9°
CAC95C94C93179.7°180.0°
CAC95C94C980.2°0.3°
C95CAN4C990.7°0.2°
C95CACOXT18.0°180.0°
C95C94C93C98179.5°179.7°
C94C95CAN40.3°0.1°
C95C94C98C990.3°0.2°
C95C94C98C97179.6°179.7°
C95C94C93H6135.3°20.3°
C95C94C93H3104.7°140.3°
C93C94C98C99179.8°180.0°
C93C94C98C970.0°0.1°
C94C93H6H3120.0°119.9°
C93C94C95H40.3°0.0°
C94C93N5H8180.0°180.0°
C94C93N5H960.0°56.0°
CAN4C99C980.6°0.3°
CAN4C99C100179.6°179.8°
N4CAC95H4179.7°180.0°
N4CACOXT163.6°0.0°
C94C98C99N40.1°0.1°
C94C98C99C97179.8°179.9°
C94C98C99C100179.1°180.0°
C94C98C97C102180.0°180.0°
C98C94C93H644.3°159.9°
C98C94C93H375.7°40.0°
C98C94C95H4179.9°179.8°
C94C98C97H50.0°0.1°
N4C99C98C100179.0°179.9°
N4C99C98C97180.0°180.0°
N4C99C100N2.7°0.1°
N4C99C100C101179.3°180.0°
C99C98C97C1020.1°0.1°
C98C99C100N178.3°180.0°
C98C99C100C1011.7°0.1°
C99C98C97H5179.9°180.0°
C97C98C99C1001.0°0.1°
C98C97C102H5180.0°179.9°
C98C97C102C1010.1°0.1°
C98C97C102H12179.9°180.0°
C99C100NC101176.4°179.9°
C99C100C101C1021.4°0.1°
C99C100NH180.0°0.1°
C99C100NH260.0°180.0°
C99C100C101H11178.5°179.9°
C97C102C101C1000.5°0.1°
C97C102C101H12180.0°179.9°
C97C102C101H11179.4°179.9°
NC100C101C102177.8°180.0°
C100NHH2120.0°179.9°
NC100C101H112.2°0.0°
C100C101C102H11180.0°180.0°
C101C100NH3.6°180.0°
C101C100NH2123.6°0.1°
C100C101C102H12179.5°179.9°
C101C102C97H5179.9°180.0°
H6C93N5H860.0°60.0°
H6C93N5H960.0°176.0°
H3C93N5H860.0°60.1°
H3C93N5H9180.0°63.9°
H5C97C102H120.2°0.1°
H11C101C102H120.5°0.1°

227344

PDB entries from 2024-11-13

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