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BB8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCAsing1.47Å1.49Å
CACsing1.51Å1.53Å
CACBsing1.53Å1.52Å
COXTsing1.34Å1.32Å
CBOBsing1.43Å1.41Å
CBCGsing1.51Å1.57Å
CGCD1sing1.38Å1.47ÅAromatic
CGCD2doub1.38Å1.44ÅAromatic
CD1CE1doub1.38Å1.43ÅAromatic
CE1CZsing1.38Å1.43ÅAromatic
CZCE2doub1.38Å1.44ÅAromatic
CE2CD2sing1.38Å1.44ÅAromatic
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CAHAsing1.09Å1.10Å
COdoub1.21Å1.72Å
CBHBsing1.09Å1.10Å
OXTHXTsing0.97Å0.95Å
OBHCsing0.97Å0.95Å
CD1HD1sing1.08Å1.08Å
CD2HD2sing1.08Å1.08Å
CE1HE1sing1.08Å1.08Å
CZHZsing1.08Å1.08Å
CE2HE2sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NCAC105.6°109.4°
NCACB108.0°109.5°
CANH109.5°111.0°
CANH2109.5°110.9°
NCAHA113.9°109.5°
CCACB112.1°109.5°
CACOXT118.3°120.0°
CCAHA109.8°109.4°
CACO126.3°120.0°
CACBOB117.5°109.5°
CACBCG109.6°109.5°
CBCAHA107.5°109.5°
CACBHB105.3°109.5°
OXTCO115.5°120.0°
COXTHXT109.5°117.0°
OBCBCG114.0°109.5°
OBCBHB99.8°109.4°
CBOBHC109.5°114.0°
CBCGCD1117.7°120.0°
CBCGCD2123.6°120.0°
CGCBHB109.5°109.5°
CD1CGCD2118.6°120.0°
CGCD1CE1120.9°120.0°
CGCD1HD1119.6°120.0°
CGCD2CE2119.9°120.0°
CGCD2HD2120.1°120.0°
CD1CE1CZ119.5°119.9°
CE1CD1HD1119.5°119.9°
CD1CE1HE1120.3°120.0°
CE1CZCE2120.6°120.0°
CZCE1HE1120.3°120.0°
CE1CZHZ119.7°120.0°
CZCE2CD2120.5°120.0°
CE2CZHZ119.7°120.0°
CZCE2HE2119.8°120.0°
CE2CD2HD2120.1°120.0°
CD2CE2HE2119.8°120.0°
HNH2109.4°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NCACCB117.3°120.0°
NCACHA123.2°119.9°
NCACBHA123.3°120.0°
NCACOXT124.0°160.0°
NCACBOB156.4°180.0°
NCACBCG71.3°60.0°
CANHH2120.0°123.9°
NCACO56.0°20.1°
NCACBHB46.5°60.0°
CCACBHA120.8°120.0°
CACOXTO180.0°180.0°
CCACBOB40.5°60.0°
CCACBCG172.8°180.0°
CCANH22.8°63.9°
CCANH297.2°60.0°
CCACBHB69.4°60.0°
CACOXTHXT180.0°180.0°
CBCACOXT118.7°80.0°
CACBOBCG130.2°120.0°
CACBOBHB113.1°120.0°
CACBCGHB115.1°120.0°
CACBCGCD176.8°100.0°
CACBCGCD2102.8°80.3°
CBCANH142.9°176.1°
CBCANH222.9°60.0°
CBCACO61.3°100.0°
CACBOBHC26.1°60.0°
OXTCCAHA0.8°40.0°
OBCBCGHB110.9°120.0°
OBCBCGCD157.3°140.0°
OBCBCGCD2123.2°39.7°
OBCBCAHA80.3°60.0°
CBCGCD1CD2179.6°179.7°
CBCGCD1CE1179.5°180.0°
CBCGCD2CE2179.2°179.8°
CGCBCAHA52.0°60.1°
CGCBOBHC104.1°60.1°
CBCGCD1HD10.5°0.0°
CBCGCD2HD20.8°0.1°
CGCD1CE1HD1180.0°180.0°
CGCD1CE1CZ0.3°0.0°
CD1CGCD2CE20.4°0.5°
CD1CGCBHB168.1°20.0°
CD1CGCD2HD2179.6°179.8°
CGCD1CE1HE1179.7°180.0°
CD2CGCD1CE10.1°0.3°
CGCD2CE2CZ0.3°0.5°
CGCD2CE2HD2180.0°179.7°
CD2CGCBHB12.3°159.7°
CD2CGCD1HD1179.9°179.7°
CGCD2CE2HE2179.7°179.8°
CD1CE1CZHE1180.0°180.0°
CD1CE1CZCE20.4°0.0°
CD1CE1CZHZ179.6°180.0°
CE1CZCE2HZ180.0°180.0°
CE1CZCE2CD20.1°0.2°
CZCE1CD1HD1179.7°179.9°
CE1CZCE2HE2179.9°180.0°
CZCE2CD2HE2180.0°179.7°
CZCE2CD2HD2179.7°179.8°
CE2CZCE1HE1179.5°180.0°
CD2CE2CZHZ179.9°179.8°
HNCAHA97.8°56.0°
H2NCAHA142.2°179.9°
HACACO179.2°140.0°
HACACBHB169.7°180.0°
OCOXTHXT0.0°0.0°
HBCBOBHC139.2°180.0°
HD1CD1CE1HE10.3°0.0°
HD2CD2CE2HE20.3°0.1°
HE1CE1CZHZ0.4°0.1°
HZCZCE2HE20.1°0.0°

223532

PDB entries from 2024-08-07

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