8MY

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N11	C10	sing	1.39Å	1.45Å
C10	N09	doub	1.33Å	1.31Å	Aromatic
C10	C12	sing	1.39Å	1.40Å	Aromatic
N09	C08	sing	1.32Å	1.34Å	Aromatic
C12	C13	doub	1.39Å	1.38Å	Aromatic
O19	C18	sing	1.43Å	1.41Å
C08	N07	sing	1.39Å	1.42Å
C08	N21	doub	1.32Å	1.30Å	Aromatic
N07	C06	sing	1.39Å	1.44Å
C13	N21	sing	1.33Å	1.32Å	Aromatic
C13	N14	sing	1.40Å	1.33Å
C22	C06	doub	1.39Å	1.38Å	Aromatic
C22	C23	sing	1.38Å	1.38Å	Aromatic
N20	N14	sing	1.40Å	1.37Å	Aromatic
N20	C17	doub	1.31Å	1.34Å	Aromatic
N14	C15	sing	1.36Å	1.32Å	Aromatic
C06	C05	sing	1.39Å	1.39Å	Aromatic
C23	C03	doub	1.40Å	1.38Å	Aromatic
C17	C18	sing	1.51Å	1.53Å
C17	C16	sing	1.40Å	1.38Å	Aromatic
C15	C16	doub	1.35Å	1.39Å	Aromatic
C05	C04	doub	1.38Å	1.39Å	Aromatic
C03	C04	sing	1.40Å	1.38Å	Aromatic
C03	C02	sing	1.43Å	1.52Å
C02	N01	trip	1.14Å	1.13Å
C15	H1	sing	1.08Å	1.08Å
C22	H2	sing	1.08Å	1.08Å
C04	H3	sing	1.08Å	1.08Å
C05	H4	sing	1.08Å	1.08Å
C12	H5	sing	1.08Å	1.08Å
C16	H6	sing	1.08Å	1.08Å
C18	H7	sing	1.09Å	1.10Å
C18	H8	sing	1.09Å	1.10Å
C23	H9	sing	1.08Å	1.08Å
N07	H10	sing	0.97Å	1.00Å
N11	H11	sing	0.97Å	1.00Å
N11	H12	sing	0.97Å	1.00Å
O19	H13	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N11	C10	N09	121.4°	120.5°
N11	C10	C12	119.6°	120.5°
C10	N11	H11	109.5°	120.1°
C10	N11	H12	109.4°	120.0°
N09	C10	C12	118.9°	119.1°
C10	N09	C08	118.8°	120.8°
C10	C12	C13	120.0°	118.4°
C10	C12	H5	120.0°	120.8°
N09	C08	N07	113.9°	119.2°
N09	C08	N21	123.5°	121.7°
C12	C13	N21	117.6°	119.1°
C12	C13	N14	120.0°	120.4°
C13	C12	H5	120.0°	120.8°
O19	C18	C17	106.2°	109.5°
O19	C18	H7	110.3°	109.5°
O19	C18	H8	110.3°	109.5°
C18	O19	H13	109.5°	114.0°
N07	C08	N21	122.6°	119.1°
C08	N07	C06	129.2°	120.0°
C08	N07	H10	115.4°	120.0°
C08	N21	C13	121.2°	120.9°
N07	C06	C22	114.4°	119.9°
N07	C06	C05	123.3°	119.9°
C06	N07	H10	115.4°	120.0°
N21	C13	N14	122.3°	120.4°
C13	N14	N20	125.2°	126.1°
C13	N14	C15	124.8°	126.1°
C06	C22	C23	118.6°	120.1°
C22	C06	C05	122.4°	120.1°
C06	C22	H2	120.7°	120.0°
C22	C23	C03	119.7°	119.9°
C23	C22	H2	120.7°	120.0°
C22	C23	H9	120.2°	120.1°
N14	N20	C17	108.1°	108.2°
N20	N14	C15	109.8°	107.8°
N20	C17	C18	127.0°	125.8°
N20	C17	C16	107.3°	108.4°
N14	C15	C16	107.0°	107.6°
N14	C15	H1	126.5°	126.2°
C06	C05	C04	118.4°	120.1°
C06	C05	H4	120.8°	120.0°
C23	C03	C04	122.1°	119.9°
C23	C03	C02	117.5°	120.1°
C03	C23	H9	120.2°	120.0°
C18	C17	C16	125.7°	125.8°
C17	C18	H7	110.3°	109.5°
C17	C18	H8	110.3°	109.5°
C17	C16	C15	107.7°	108.0°
C17	C16	H6	126.2°	126.0°
C16	C15	H1	126.5°	126.2°
C15	C16	H6	126.1°	126.0°
C05	C04	C03	118.9°	119.9°
C05	C04	H3	120.6°	120.0°
C04	C05	H4	120.8°	119.9°
C04	C03	C02	120.5°	120.0°
C03	C04	H3	120.5°	120.1°
C03	C02	N01	178.3°	180.0°
H7	C18	H8	109.5°	109.5°
H11	N11	H12	109.5°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N11	C10	N09	C12	179.0°	179.7°
N11	C10	N09	C08	178.8°	179.7°
N11	C10	C12	C13	179.7°	179.8°
N11	C10	C12	H5	0.3°	0.3°
C10	N11	H11	H12	120.0°	180.0°
N09	C10	C12	C13	0.7°	0.0°
C10	N09	C08	N07	180.0°	180.0°
C10	N09	C08	N21	0.4°	0.0°
N09	C10	C12	H5	179.3°	179.9°
N09	C10	N11	H11	0.0°	0.0°
N09	C10	N11	H12	120.0°	180.0°
C12	C10	N09	C08	0.1°	0.0°
C10	C12	C13	H5	180.0°	179.9°
C10	C12	C13	N21	1.3°	0.0°
C10	C12	C13	N14	178.8°	180.0°
C12	C10	N11	H11	178.9°	179.7°
C12	C10	N11	H12	61.0°	0.3°
N09	C08	N07	N21	179.6°	179.9°
N09	C08	N07	C06	179.8°	5.5°
N09	C08	N21	C13	0.1°	0.0°
N09	C08	N07	H10	0.2°	174.4°
C12	C13	N21	C08	1.0°	0.0°
C12	C13	N21	N14	177.4°	180.0°
C12	C13	N14	N20	6.4°	0.1°
C12	C13	N14	C15	168.8°	179.9°
O19	C18	C17	N20	51.4°	179.4°
O19	C18	C17	H7	119.5°	120.0°
O19	C18	C17	H8	119.5°	120.0°
O19	C18	C17	C16	128.3°	0.0°
O19	C18	H7	H8	121.5°	120.0°
C08	N07	C06	H10	180.0°	180.0°
N07	C08	N21	C13	179.4°	180.0°
C08	N07	C06	C22	164.2°	146.3°
C08	N07	C06	C05	17.1°	33.6°
N21	C08	N07	C06	0.6°	174.4°
C08	N21	C13	N14	178.4°	180.0°
N21	C08	N07	H10	179.4°	5.6°
N07	C06	C22	C05	178.7°	180.0°
N07	C06	C22	C23	178.8°	180.0°
N07	C06	C05	C04	178.5°	180.0°
N07	C06	C22	H2	1.2°	0.2°
N07	C06	C05	H4	1.5°	0.0°
N21	C13	N14	N20	176.2°	180.0°
N21	C13	N14	C15	8.6°	0.1°
N21	C13	C12	H5	178.8°	179.9°
C13	N14	N20	C15	175.7°	180.0°
C13	N14	N20	C17	177.2°	179.7°
C13	N14	C15	C16	177.4°	180.0°
C13	N14	C15	H1	2.6°	0.3°
N14	C13	C12	H5	1.3°	0.1°
C06	C22	C23	H2	180.0°	179.9°
C06	C22	C23	C03	0.5°	0.1°
C22	C06	C05	C04	0.1°	0.1°
C22	C06	C05	H4	179.9°	180.0°
C06	C22	C23	H9	179.5°	180.0°
C22	C06	N07	H10	15.8°	33.7°
C23	C22	C06	C05	0.1°	0.1°
C22	C23	C03	H9	180.0°	179.9°
C22	C23	C03	C04	0.7°	0.1°
C22	C23	C03	C02	179.9°	180.0°
N14	N20	C17	C18	179.6°	179.9°
N14	N20	C17	C16	0.6°	0.5°
N20	N14	C15	C16	1.6°	0.1°
N20	N14	C15	H1	178.3°	179.7°
C17	N20	N14	C15	1.4°	0.2°
N20	C17	C18	C16	179.8°	179.4°
N20	C17	C16	C15	0.4°	0.5°
N20	C17	C16	H6	179.6°	179.6°
N20	C17	C18	H7	170.9°	59.4°
N20	C17	C18	H8	68.1°	60.5°
N14	C15	C16	C17	1.3°	0.3°
N14	C15	C16	H1	180.0°	179.7°
N14	C15	C16	H6	178.8°	179.8°
C06	C05	C04	H4	180.0°	179.9°
C06	C05	C04	C03	0.2°	0.1°
C05	C06	C22	H2	179.9°	179.8°
C06	C05	C04	H3	179.9°	179.9°
C05	C06	N07	H10	162.9°	146.4°
C23	C03	C04	C05	0.5°	0.1°
C23	C03	C04	C02	179.2°	179.9°
C23	C03	C02	N01	4.8°	12.4°
C03	C23	C22	H2	179.6°	179.8°
C23	C03	C04	H3	179.5°	179.9°
C18	C17	C16	C15	179.4°	180.0°
C18	C17	C16	H6	0.6°	0.1°
C17	C18	H7	H8	121.5°	120.0°
C17	C18	O19	H13	180.0°	180.0°
C17	C16	C15	H6	180.0°	179.9°
C17	C16	C15	H1	178.7°	180.0°
C16	C17	C18	H7	8.9°	120.0°
C16	C17	C18	H8	112.2°	120.0°
C05	C04	C03	H3	180.0°	180.0°
C05	C04	C03	C02	179.7°	180.0°
C04	C03	C02	N01	174.4°	167.7°
C03	C04	C05	H4	179.8°	180.0°
C04	C03	C23	H9	179.3°	180.0°
C02	C03	C04	H3	0.3°	0.0°
C02	C03	C23	H9	0.1°	0.1°
H1	C15	C16	H6	1.3°	0.1°
H2	C22	C23	H9	0.4°	0.1°
H3	C04	C05	H4	0.2°	0.0°
H7	C18	O19	H13	60.6°	60.0°
H8	C18	O19	H13	60.5°	60.0°

Release date:	2017-06-07
Definition date:	2017-02-20
Last modified:	2017-06-02
Release status:	REL
Processing site:	RCSB
Derived from:	5UT6