9P1

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C28	N27	sing	1.47Å	1.46Å
C29	N27	sing	1.46Å	1.46Å
N27	C24	sing	1.40Å	1.41Å
C24	C25	doub	1.39Å	1.40Å	Aromatic
C24	C23	sing	1.39Å	1.40Å	Aromatic
C25	C26	sing	1.38Å	1.39Å	Aromatic
C23	C22	doub	1.38Å	1.39Å	Aromatic
C26	C21	doub	1.38Å	1.40Å	Aromatic
C22	C21	sing	1.38Å	1.40Å	Aromatic
C21	C13	sing	1.51Å	1.52Å
N12	C13	sing	1.47Å	1.47Å
N12	C11	sing	1.47Å	1.47Å
C11	C08	sing	1.51Å	1.51Å
C08	C09	doub	1.36Å	1.40Å	Aromatic
C08	C07	sing	1.39Å	1.40Å	Aromatic
C09	C10	sing	1.41Å	1.40Å	Aromatic
C07	C06	doub	1.36Å	1.39Å	Aromatic
C10	N01	doub	1.34Å	1.35Å	Aromatic
C10	C05	sing	1.42Å	1.40Å	Aromatic
N01	C02	sing	1.32Å	1.35Å	Aromatic
C06	C05	sing	1.40Å	1.39Å	Aromatic
C05	C04	doub	1.41Å	1.39Å	Aromatic
C02	N02	sing	1.39Å	1.35Å
C02	C03	doub	1.40Å	1.39Å	Aromatic
C04	C03	sing	1.36Å	1.39Å	Aromatic
C04	H1	sing	1.08Å	1.08Å
C11	H2	sing	1.09Å	1.10Å
C11	H3	sing	1.09Å	1.10Å
C13	H4	sing	1.09Å	1.10Å
C13	H5	sing	1.09Å	1.10Å
C03	H6	sing	1.08Å	1.08Å
C06	H7	sing	1.08Å	1.08Å
C22	H8	sing	1.08Å	1.08Å
C25	H9	sing	1.08Å	1.08Å
C26	H10	sing	1.08Å	1.08Å
C28	H11	sing	1.09Å	1.10Å
C28	H12	sing	1.09Å	1.10Å
C28	H13	sing	1.09Å	1.10Å
C29	H14	sing	1.09Å	1.10Å
C29	H15	sing	1.09Å	1.10Å
C29	H16	sing	1.09Å	1.10Å
N02	H17	sing	0.97Å	1.00Å
N02	H18	sing	0.97Å	1.00Å
C07	H19	sing	1.08Å	1.08Å
C09	H20	sing	1.08Å	1.08Å
N12	H21	sing	1.01Å	1.00Å
C23	H23	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C28	N27	C29	119.9°	120.0°
C28	N27	C24	120.6°	120.0°
N27	C28	H11	109.5°	109.5°
N27	C28	H12	109.4°	109.4°
N27	C28	H13	109.5°	109.5°
C29	N27	C24	119.4°	120.0°
N27	C29	H14	109.5°	109.4°
N27	C29	H15	109.5°	109.5°
N27	C29	H16	109.5°	109.5°
N27	C24	C25	119.8°	120.1°
N27	C24	C23	120.7°	120.1°
C25	C24	C23	119.5°	119.8°
C24	C25	C26	120.1°	119.9°
C24	C25	H9	119.9°	120.0°
C24	C23	C22	120.4°	119.9°
C24	C23	H23	119.8°	120.1°
C25	C26	C21	120.3°	120.1°
C26	C25	H9	119.9°	120.1°
C25	C26	H10	119.8°	119.9°
C23	C22	C21	120.1°	120.1°
C23	C22	H8	119.9°	120.0°
C22	C23	H23	119.8°	120.0°
C26	C21	C22	119.6°	120.2°
C26	C21	C13	119.8°	119.9°
C21	C26	H10	119.9°	120.0°
C22	C21	C13	120.7°	120.0°
C21	C22	H8	119.9°	120.0°
C21	C13	N12	114.0°	109.5°
C21	C13	H4	108.3°	109.5°
C21	C13	H5	108.3°	109.5°
C13	N12	C11	107.1°	111.0°
N12	C13	H4	108.3°	109.5°
N12	C13	H5	108.3°	109.4°
C13	N12	H21	110.1°	111.0°
N12	C11	C08	112.1°	109.4°
N12	C11	H2	108.8°	109.4°
N12	C11	H3	108.8°	109.5°
C11	N12	H21	110.1°	111.0°
C11	C08	C09	119.4°	119.5°
C11	C08	C07	121.0°	119.5°
C08	C11	H2	108.8°	109.5°
C08	C11	H3	108.8°	109.5°
C09	C08	C07	119.7°	121.0°
C08	C09	C10	119.6°	119.8°
C08	C09	H20	120.2°	120.1°
C08	C07	C06	120.7°	120.9°
C08	C07	H19	119.7°	119.6°
C09	C10	N01	119.5°	121.0°
C09	C10	C05	120.5°	119.1°
C10	C09	H20	120.2°	120.1°
C07	C06	C05	119.4°	119.6°
C07	C06	H7	120.3°	120.2°
C06	C07	H19	119.7°	119.5°
N01	C10	C05	120.0°	119.9°
C10	N01	C02	121.1°	121.2°
C10	C05	C06	120.1°	119.6°
C10	C05	C04	119.7°	119.1°
N01	C02	N02	119.7°	119.2°
N01	C02	C03	120.7°	121.6°
C06	C05	C04	120.2°	121.3°
C05	C06	H7	120.3°	120.2°
C05	C04	C03	119.0°	118.3°
C05	C04	H1	120.5°	120.8°
N02	C02	C03	119.6°	119.2°
C02	N02	H17	109.5°	120.0°
C02	N02	H18	109.5°	120.0°
C02	C03	C04	119.5°	119.9°
C02	C03	H6	120.3°	120.1°
C03	C04	H1	120.5°	120.9°
C04	C03	H6	120.2°	120.1°
H2	C11	H3	109.5°	109.5°
H4	C13	H5	109.5°	109.4°
H11	C28	H12	109.5°	109.5°
H11	C28	H13	109.5°	109.5°
H12	C28	H13	109.5°	109.5°
H14	C29	H15	109.5°	109.5°
H14	C29	H16	109.5°	109.5°
H15	C29	H16	109.5°	109.4°
H17	N02	H18	109.4°	120.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C28	N27	C29	C24	180.0°	180.0°
C28	N27	C24	C25	144.1°	0.0°
C28	N27	C24	C23	35.9°	179.8°
N27	C28	H11	H12	120.0°	120.0°
N27	C28	H11	H13	120.0°	120.0°
N27	C28	H12	H13	120.0°	120.0°
C28	N27	C29	H14	180.0°	90.0°
C28	N27	C29	H15	60.0°	150.0°
C28	N27	C29	H16	60.0°	30.0°
C29	N27	C24	C25	35.9°	180.0°
C29	N27	C24	C23	144.1°	0.2°
C29	N27	C28	H11	180.0°	0.0°
C29	N27	C28	H12	60.0°	120.0°
C29	N27	C28	H13	60.0°	120.0°
N27	C29	H14	H15	120.0°	120.0°
N27	C29	H14	H16	120.0°	120.0°
N27	C29	H15	H16	120.0°	120.0°
N27	C24	C25	C23	179.9°	179.8°
N27	C24	C25	C26	179.8°	180.0°
N27	C24	C23	C22	179.8°	180.0°
N27	C24	C25	H9	0.1°	0.3°
C24	N27	C28	H11	0.0°	180.0°
C24	N27	C28	H12	120.0°	60.0°
C24	N27	C28	H13	120.0°	60.0°
C24	N27	C29	H14	0.0°	90.0°
C24	N27	C29	H15	120.0°	30.0°
C24	N27	C29	H16	120.0°	150.0°
N27	C24	C23	H23	0.2°	0.3°
C24	C25	C26	H9	180.0°	179.7°
C25	C24	C23	C22	0.2°	0.2°
C24	C25	C26	C21	0.4°	0.0°
C24	C25	C26	H10	179.6°	180.0°
C25	C24	C23	H23	179.9°	179.9°
C23	C24	C25	C26	0.1°	0.2°
C24	C23	C22	H23	180.0°	179.7°
C24	C23	C22	C21	0.4°	0.0°
C24	C23	C22	H8	179.6°	180.0°
C23	C24	C25	H9	179.9°	180.0°
C25	C26	C21	H10	180.0°	179.9°
C25	C26	C21	C22	0.6°	0.2°
C25	C26	C21	C13	179.7°	180.0°
C23	C22	C21	C26	0.7°	0.3°
C23	C22	C21	H8	180.0°	179.9°
C23	C22	C21	C13	179.8°	180.0°
C26	C21	C22	C13	179.1°	179.7°
C26	C21	C13	N12	98.0°	90.3°
C26	C21	C13	H4	141.3°	29.8°
C26	C21	C13	H5	22.6°	149.7°
C26	C21	C22	H8	179.3°	179.8°
C21	C26	C25	H9	179.7°	179.7°
C22	C21	C13	N12	82.9°	90.0°
C22	C21	C13	H4	37.8°	150.0°
C22	C21	C13	H5	156.5°	30.0°
C22	C21	C26	H10	179.4°	179.7°
C21	C22	C23	H23	179.6°	179.7°
C21	C13	N12	H4	120.6°	120.1°
C21	C13	N12	H5	120.6°	120.0°
C21	C13	N12	C11	110.8°	180.0°
C21	C13	H4	H5	117.9°	120.0°
C13	C21	C22	H8	0.2°	0.1°
C13	C21	C26	H10	0.3°	0.0°
C21	C13	N12	H21	129.6°	56.0°
C13	N12	C11	H21	119.6°	124.0°
C13	N12	C11	C08	133.0°	180.0°
C13	N12	C11	H2	106.6°	60.1°
C13	N12	C11	H3	12.6°	60.0°
N12	C13	H4	H5	118.0°	119.9°
N12	C11	C08	H2	120.4°	119.9°
N12	C11	C08	H3	120.4°	120.0°
N12	C11	C08	C09	153.4°	90.0°
N12	C11	C08	C07	26.8°	90.4°
N12	C11	H2	H3	118.8°	120.0°
C11	N12	C13	H4	9.8°	59.9°
C11	N12	C13	H5	128.5°	60.0°
C11	C08	C09	C07	179.9°	179.6°
C11	C08	C09	C10	179.8°	179.9°
C11	C08	C07	C06	178.5°	179.7°
C08	C11	H2	H3	118.8°	120.1°
C11	C08	C07	H19	1.5°	0.4°
C11	C08	C09	H20	0.2°	0.0°
C08	C11	N12	H21	13.4°	56.0°
C08	C09	C10	H20	180.0°	179.9°
C09	C08	C07	C06	1.3°	0.7°
C08	C09	C10	N01	179.8°	180.0°
C08	C09	C10	C05	0.6°	0.0°
C09	C08	C11	H2	33.0°	150.0°
C09	C08	C11	H3	86.2°	30.0°
C09	C08	C07	H19	178.6°	180.0°
C07	C08	C09	C10	0.1°	0.3°
C08	C07	C06	H19	180.0°	179.3°
C08	C07	C06	C05	1.9°	0.6°
C07	C08	C11	H2	147.1°	29.6°
C07	C08	C11	H3	93.6°	149.6°
C08	C07	C06	H7	178.1°	179.3°
C07	C08	C09	H20	179.9°	179.6°
C09	C10	N01	C05	179.6°	180.0°
C09	C10	N01	C02	179.9°	179.9°
C09	C10	C05	C06	0.0°	0.1°
C09	C10	C05	C04	179.5°	179.7°
C07	C06	C05	C10	1.2°	0.3°
C07	C06	C05	H7	180.0°	179.9°
C07	C06	C05	C04	179.3°	180.0°
N01	C10	C05	C06	179.7°	179.9°
N01	C10	C05	C04	0.1°	0.4°
C10	N01	C02	N02	179.7°	180.0°
C10	N01	C02	C03	1.2°	0.3°
N01	C10	C09	H20	0.2°	0.1°
C05	C10	N01	C02	0.5°	0.1°
C10	C05	C06	C04	179.5°	179.7°
C10	C05	C04	C03	0.0°	0.3°
C10	C05	C04	H1	180.0°	179.8°
C10	C05	C06	H7	178.8°	179.7°
C05	C10	C09	H20	179.4°	179.9°
N01	C02	N02	C03	179.1°	179.7°
N01	C02	C03	C04	1.3°	0.3°
N01	C02	C03	H6	178.7°	179.7°
N01	C02	N02	H17	0.0°	179.7°
N01	C02	N02	H18	120.0°	0.3°
C06	C05	C04	C03	179.5°	180.0°
C06	C05	C04	H1	0.5°	0.1°
C05	C06	C07	H19	178.1°	180.0°
C05	C04	C03	C02	0.7°	0.0°
C05	C04	C03	H1	180.0°	179.9°
C05	C04	C03	H6	179.3°	180.0°
C04	C05	C06	H7	0.8°	0.0°
N02	C02	C03	C04	179.6°	180.0°
N02	C02	C03	H6	0.5°	0.0°
C02	N02	H17	H18	120.0°	179.9°
C02	C03	C04	H6	180.0°	180.0°
C02	C03	C04	H1	179.3°	180.0°
C03	C02	N02	H17	179.1°	0.0°
C03	C02	N02	H18	59.1°	180.0°
H1	C04	C03	H6	0.7°	0.1°
H2	C11	N12	H21	133.8°	64.0°
H3	C11	N12	H21	107.0°	176.0°
H4	C13	N12	H21	109.8°	176.1°
H5	C13	N12	H21	8.9°	64.0°
H7	C06	C07	H19	2.0°	0.1°
H8	C22	C23	H23	0.4°	0.3°
H9	C25	C26	H10	0.3°	0.3°
H11	C28	H12	H13	120.0°	120.0°
H14	C29	H15	H16	120.0°	120.0°

Release date:	2017-08-16
Definition date:	2017-05-24
Last modified:	2017-08-11
Release status:	REL
Processing site:	RCSB
Derived from:	5VUX