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432

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
COdoub1.21Å1.26Å
CCAsing1.51Å1.49Å
NCAsing1.47Å1.49Å
CACBsing1.53Å1.53Å
CBOGsing1.45Å1.41Å
OACC1Adoub1.21Å1.23Å
OGC1Asing1.34Å1.44Å
C1AC2Asing1.51Å1.52Å
C2AC1sing1.53Å1.53Å
C1C2sing1.53Å1.52Å
C2H1sing1.09Å1.10Å
C2H12sing1.09Å1.10Å
C2H3sing1.09Å1.10Å
C1H4sing1.09Å1.10Å
C1H5sing1.09Å1.10Å
CBH6sing1.09Å1.10Å
CBH7sing1.09Å1.10Å
CAHAsing1.09Å1.10Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
C2AH13sing1.09Å1.10Å
C2AH14sing1.09Å1.10Å
COXTsing1.34Å53.53Å
OXTHXTsing0.97Å0.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA117.7°120.0°
OCOXT167.9°120.0°
CCAN113.7°109.4°
CCACB107.0°109.4°
CCAHA108.1°109.5°
CACOXT72.9°120.0°
NCACB111.9°109.5°
NCAHA108.2°109.5°
CANH109.5°111.0°
CANH2109.5°111.0°
CACBOG106.4°109.4°
CACBH6110.2°109.5°
CACBH7110.2°109.5°
CBCAHA107.7°109.5°
CBOGC1A119.8°117.0°
OGCBH6110.2°109.4°
OGCBH7110.2°109.4°
OACC1AOG118.3°120.0°
OACC1AC2A123.1°120.0°
OGC1AC2A118.6°120.0°
C1AC2AC1110.7°109.4°
C1AC2AH13109.2°109.5°
C1AC2AH14109.1°109.5°
C2AC1C2111.2°109.5°
C2AC1H4109.0°109.5°
C2AC1H5109.0°109.4°
C1C2AH13109.2°109.5°
C1C2AH14109.2°109.4°
C1C2H1109.5°109.5°
C1C2H12109.5°109.5°
C1C2H3109.5°109.4°
C2C1H4109.0°109.5°
C2C1H5109.0°109.5°
H1C2H12109.5°109.5°
H1C2H3109.5°109.5°
H12C2H3109.5°109.5°
H4C1H5109.5°109.5°
H6CBH7109.5°109.5°
HNH2109.5°111.0°
H13C2AH14109.5°109.5°
COXTHXT90.0°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAOXT173.6°180.0°
OCCAN172.1°20.0°
OCCACB63.9°99.9°
OCCAHA51.9°140.0°
OCOXTHXT90.0°0.0°
CCANCB121.3°120.0°
CCANHA120.1°120.0°
CCACBHA116.1°120.0°
CCACBOG175.1°175.0°
CCACBH665.4°65.0°
CCACBH755.6°55.1°
CCANH180.0°64.0°
CCANH260.0°60.0°
CACOXTHXT90.0°180.0°
NCACBHA118.8°120.0°
NCACBOG59.8°65.0°
NCACBH659.7°54.9°
NCACBH7179.3°175.0°
CANHH2120.0°124.0°
NCACOXT14.3°160.0°
CACBOGH6119.5°120.0°
CACBOGH7119.5°120.0°
CACBOGC1A97.6°180.0°
CACBH6H7121.4°120.1°
CBCANH58.6°176.1°
CBCANH2178.7°60.0°
CBCACOXT109.7°80.0°
CBOGC1AOAC6.3°0.0°
CBOGC1AC2A173.7°180.0°
OGCBH6H7121.4°119.9°
OGCBCAHA59.0°55.0°
OACC1AOGC2A179.9°180.0°
OACC1AC2AC18.6°0.0°
OACC1AC2AH13128.8°120.0°
OACC1AC2AH14111.6°119.9°
OGC1AC2AC1171.3°180.0°
C1AOGCBH622.0°60.0°
C1AOGCBH7142.9°60.0°
OGC1AC2AH1351.1°60.0°
OGC1AC2AH1468.5°60.0°
C1AC2AC1H13120.2°120.0°
C1AC2AC1H14120.2°120.0°
C1AC2AC1C283.3°180.0°
C1AC2AC1H4156.4°60.0°
C1AC2AC1H537.0°60.0°
C1AC2AH13H14119.4°120.0°
C2AC1C2H4120.3°120.0°
C2AC1C2H5120.3°119.9°
C2AC1C2H1180.0°60.0°
C2AC1C2H1260.0°180.0°
C2AC1C2H360.0°60.0°
C2AC1H4H5119.2°120.0°
C1C2AH13H14119.4°120.0°
C1C2H1H12120.0°120.0°
C1C2H1H3120.0°119.9°
C1C2H12H3120.0°119.9°
C2C1H4H5119.2°120.0°
C2C1C2AH1336.9°60.0°
C2C1C2AH14156.5°60.0°
H1C2H12H3120.0°120.1°
H1C2C1H459.7°180.0°
H1C2C1H559.7°60.0°
H12C2C1H4179.7°60.0°
H12C2C1H560.3°60.1°
H3C2C1H460.3°60.0°
H3C2C1H5179.7°180.0°
H4C1C2AH1383.4°180.0°
H4C1C2AH1436.2°60.0°
H5C1C2AH13157.2°60.0°
H5C1C2AH1483.2°180.0°
H6CBCAHA178.6°175.0°
H7CBCAHA60.5°65.0°
HACANH59.9°56.0°
HACANH260.2°180.0°
HACACOXT134.5°40.0°

223532

PDB entries from 2024-08-07

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