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OTH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCAsing1.47Å1.46Å
NC24sing1.47Å1.47Å
NHsing1.01Å1.00Å
CCAsing1.51Å1.51Å
COdoub1.21Å1.22Å
COXTsing1.34Å1.43Å
CACBsing1.53Å1.54Å
CAHAsing1.09Å1.10Å
OG1CBsing1.43Å1.53Å
OG1C22sing1.43Å1.67Å
CBCG2sing1.53Å1.59Å
CBHBsing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C22H22Bsing1.09Å1.10Å
CG2HG1sing1.09Å1.10Å
CG2HG2sing1.09Å1.10Å
CG2HG3sing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C24H24Bsing1.09Å1.10Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CANC24116.7°111.0°
CANH107.1°111.0°
NCAC109.4°109.5°
NCACB110.7°109.5°
NCAHA109.0°109.5°
C24NH107.1°111.0°
NC24H24109.5°109.5°
NC24H24A109.5°109.5°
NC24H24B109.4°109.5°
CACO121.2°120.0°
CACOXT119.4°120.0°
CCACB110.4°109.5°
CCAHA109.3°109.4°
OCOXT119.4°120.0°
COXTHXT109.5°117.0°
CBCAHA107.9°109.4°
CACBOG1111.3°109.4°
CACBCG2107.9°109.5°
CACBHB109.7°109.5°
CBOG1C22103.1°114.0°
OG1CBCG2110.4°109.5°
OG1CBHB107.0°109.5°
OG1C22H22109.5°109.5°
OG1C22H22A109.4°109.5°
OG1C22H22B109.5°109.5°
CG2CBHB110.5°109.5°
CBCG2HG1109.5°109.5°
CBCG2HG2109.5°109.5°
CBCG2HG3109.5°109.4°
H22C22H22A109.5°109.4°
H22C22H22B109.5°109.5°
H22AC22H22B109.5°109.5°
HG1CG2HG2109.5°109.4°
HG1CG2HG3109.5°109.5°
HG2CG2HG3109.4°109.5°
H24C24H24A109.5°109.5°
H24C24H24B109.5°109.5°
H24AC24H24B109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CANC24H120.0°124.0°
NCACCB122.1°120.0°
NCACHA119.3°120.0°
NCACO74.9°22.6°
NCACOXT105.2°157.4°
NCACBHA119.3°120.0°
NCACBOG14.0°60.5°
NCACBCG2125.3°59.5°
NCACBHB114.3°179.6°
CANC24H24180.0°55.3°
CANC24H24A60.0°64.7°
CANC24H24B60.0°175.3°
C24NCAC35.4°83.3°
C24NCACB86.5°156.6°
C24NCAHA154.9°36.6°
NC24H24H24A120.0°120.0°
NC24H24H24B120.0°120.0°
NC24H24AH24B120.0°120.0°
HNCAC155.4°40.6°
HNCACB33.5°79.4°
HNCAHA85.1°160.6°
HNC24H2460.0°179.3°
HNC24H24A180.0°59.3°
HNC24H24B60.0°60.7°
CACOOXT180.0°179.9°
CCACBHA119.5°120.0°
CCACBOG1125.2°59.6°
CCACBCG2113.5°179.5°
CCACBHB7.0°60.4°
CACOXTHXT180.0°180.0°
OCCACB47.2°97.4°
OCCAHA165.8°142.6°
OCOXTHXT0.0°0.0°
OXTCCACB132.8°82.5°
OXTCCAHA14.2°37.4°
CACBOG1CG2119.8°120.0°
CACBOG1HB119.8°120.0°
CACBOG1C22117.6°150.0°
CACBCG2HB119.9°120.0°
CACBCG2HG1180.0°60.0°
CACBCG2HG260.0°179.9°
CACBCG2HG360.0°60.0°
HACACBOG1115.3°179.5°
HACACBCG26.0°60.5°
HACACBHB126.4°59.6°
OG1CBCG2HB118.3°120.0°
CBOG1C22H22180.0°60.0°
CBOG1C22H22A60.0°60.0°
CBOG1C22H22B60.0°180.0°
OG1CBCG2HG158.1°60.0°
OG1CBCG2HG2178.2°60.0°
OG1CBCG2HG361.9°180.0°
C22OG1CBCG2122.6°90.0°
C22OG1CBHB2.2°30.1°
OG1C22H22H22A120.0°120.0°
OG1C22H22H22B120.0°120.0°
OG1C22H22AH22B120.0°120.1°
CBCG2HG1HG2120.0°120.0°
CBCG2HG1HG3120.0°120.0°
CBCG2HG2HG3120.0°120.0°
HBCBCG2HG160.1°180.0°
HBCBCG2HG259.9°60.0°
HBCBCG2HG3179.9°60.0°
H22C22H22AH22B120.0°120.0°
HG1CG2HG2HG3120.0°120.0°
H24C24H24AH24B120.0°120.0°

222415

PDB entries from 2024-07-10

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