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Summary Geometry Related PDB entries

98Z

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N01	C02	trip	1.14Å	1.13Å
C02	C03	sing	1.43Å	1.52Å
C03	C04	doub	1.36Å	1.39Å	Aromatic
C03	C11	sing	1.47Å	1.42Å	Aromatic
C04	N05	sing	1.36Å	1.32Å	Aromatic
N05	C06	sing	1.38Å	1.36Å	Aromatic
C11	C10	doub	1.39Å	1.42Å	Aromatic
C11	C06	sing	1.40Å	1.37Å	Aromatic
C10	C09	sing	1.38Å	1.39Å	Aromatic
C06	C07	doub	1.39Å	1.42Å	Aromatic
C09	C08	doub	1.39Å	1.40Å	Aromatic
C07	C08	sing	1.38Å	1.39Å	Aromatic
C10	H1	sing	1.08Å	1.08Å
C04	H2	sing	1.08Å	1.08Å
N05	H3	sing	0.97Å	1.00Å
C07	H4	sing	1.08Å	1.08Å
C08	H5	sing	1.08Å	1.08Å
C09	H6	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N01	C02	C03	179.4°	179.9°
C02	C03	C04	126.5°	126.8°
C02	C03	C11	127.3°	126.7°
C04	C03	C11	106.3°	106.5°
C03	C04	N05	108.4°	109.8°
C03	C04	H2	125.8°	125.1°
C03	C11	C10	133.7°	134.0°
C03	C11	C06	106.5°	105.9°
C04	N05	C06	110.7°	110.3°
N05	C04	H2	125.8°	125.1°
C04	N05	H3	124.6°	124.9°
N05	C06	C11	108.1°	107.5°
N05	C06	C07	131.7°	133.1°
C06	N05	H3	124.6°	124.8°
C10	C11	C06	119.8°	120.1°
C11	C10	C09	120.0°	119.7°
C11	C10	H1	120.0°	120.2°
C11	C06	C07	120.2°	119.4°
C10	C09	C08	120.3°	120.3°
C09	C10	H1	120.0°	120.1°
C10	C09	H6	119.9°	119.9°
C06	C07	C08	119.9°	119.9°
C06	C07	H4	120.0°	120.1°
C09	C08	C07	119.9°	120.7°
C09	C08	H5	120.1°	119.7°
C08	C09	H6	119.9°	119.8°
C08	C07	H4	120.1°	120.0°
C07	C08	H5	120.1°	119.7°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N01	C02	C03	C04	0.9°	50.3°
N01	C02	C03	C11	179.1°	129.8°
C02	C03	C04	C11	180.0°	180.0°
C02	C03	C04	N05	179.9°	180.0°
C02	C03	C11	C10	0.1°	0.1°
C02	C03	C11	C06	179.8°	180.0°
C02	C03	C04	H2	0.1°	0.1°
C03	C04	N05	H2	180.0°	179.9°
C03	C04	N05	C06	0.0°	0.0°
C04	C03	C11	C10	179.9°	179.9°
C04	C03	C11	C06	0.2°	0.0°
C03	C04	N05	H3	180.0°	179.9°
C11	C03	C04	N05	0.1°	0.0°
C03	C11	C06	N05	0.2°	0.1°
C03	C11	C10	C06	179.7°	179.9°
C03	C11	C10	C09	179.9°	179.9°
C03	C11	C06	C07	179.9°	180.0°
C03	C11	C10	H1	0.1°	0.2°
C11	C03	C04	H2	179.9°	179.9°
C04	N05	C06	H3	180.0°	179.9°
C04	N05	C06	C11	0.1°	0.1°
C04	N05	C06	C07	179.7°	180.0°
N05	C06	C11	C10	179.9°	180.0°
N05	C06	C11	C07	179.7°	179.9°
N05	C06	C07	C08	179.7°	179.7°
C06	N05	C04	H2	180.0°	179.9°
N05	C06	C07	H4	0.3°	0.1°
C11	C10	C09	H1	180.0°	179.8°
C10	C11	C06	C07	0.4°	0.1°
C11	C10	C09	C08	0.1°	0.3°
C11	C10	C09	H6	179.9°	179.8°
C06	C11	C10	C09	0.4°	0.0°
C11	C06	C07	C08	0.1°	0.2°
C06	C11	C10	H1	179.6°	179.7°
C11	C06	N05	H3	179.9°	180.0°
C11	C06	C07	H4	179.9°	180.0°
C10	C09	C08	H6	180.0°	179.9°
C10	C09	C08	C07	0.1°	0.6°
C10	C09	C08	H5	179.9°	179.9°
C06	C07	C08	C09	0.1°	0.5°
C06	C07	C08	H4	180.0°	179.8°
C07	C06	N05	H3	0.2°	0.1°
C06	C07	C08	H5	179.9°	180.0°
C09	C08	C07	H5	180.0°	179.5°
C08	C09	C10	H1	179.9°	180.0°
C09	C08	C07	H4	179.8°	179.7°
C07	C08	C09	H6	179.9°	179.5°
H1	C10	C09	H6	0.1°	0.0°
H2	C04	N05	H3	0.0°	0.0°
H4	C07	C08	H5	0.2°	0.2°
H5	C08	C09	H6	0.1°	0.0°

248335

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