N03

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C17	C16	sing	1.51Å	1.50Å
O18	C16	doub	1.21Å	1.22Å
C15	C13	sing	1.51Å	1.51Å
C16	C12	sing	1.46Å	1.50Å
C13	C12	doub	1.38Å	1.49Å	Aromatic
C13	N14	sing	1.34Å	1.36Å	Aromatic
C12	C11	sing	1.47Å	1.49Å	Aromatic
N14	C10	sing	1.37Å	1.35Å	Aromatic
C11	C19	sing	1.48Å	1.48Å
C11	C10	doub	1.38Å	1.49Å	Aromatic
C20	C19	doub	1.39Å	1.39Å	Aromatic
C20	C21	sing	1.38Å	1.39Å	Aromatic
C19	C24	sing	1.40Å	1.39Å	Aromatic
C10	C8	sing	1.47Å	1.52Å
C21	C22	doub	1.38Å	1.39Å	Aromatic
C24	C23	doub	1.38Å	1.39Å	Aromatic
C22	C23	sing	1.38Å	1.39Å	Aromatic
C8	N9	doub	1.31Å	1.34Å	Aromatic
C8	N7	sing	1.37Å	1.36Å	Aromatic
N9	C2	sing	1.36Å	1.34Å	Aromatic
N7	C3	sing	1.38Å	1.37Å	Aromatic
C2	C3	doub	1.41Å	1.47Å	Aromatic
C2	C1	sing	1.40Å	1.35Å	Aromatic
C3	C4	sing	1.39Å	1.38Å	Aromatic
C1	C6	doub	1.38Å	1.37Å	Aromatic
C4	C5	doub	1.38Å	1.38Å	Aromatic
C6	C5	sing	1.39Å	1.40Å	Aromatic
C6	N25	sing	1.40Å	1.33Å
C1	H1	sing	1.08Å	1.08Å
C15	H2	sing	1.09Å	1.10Å
C15	H3	sing	1.09Å	1.10Å
C15	H4	sing	1.09Å	1.10Å
C17	H5	sing	1.09Å	1.10Å
C17	H6	sing	1.09Å	1.10Å
C17	H7	sing	1.09Å	1.10Å
C20	H8	sing	1.08Å	1.08Å
C21	H9	sing	1.08Å	1.08Å
C22	H10	sing	1.08Å	1.08Å
C23	H11	sing	1.08Å	1.08Å
C24	H12	sing	1.08Å	1.08Å
C4	H13	sing	1.08Å	1.08Å
C5	H14	sing	1.08Å	1.08Å
N14	H15	sing	0.97Å	1.00Å
N25	H16	sing	0.97Å	1.00Å
N25	H17	sing	0.97Å	1.00Å
N7	H18	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C17	C16	O18	120.8°	120.0°
C17	C16	C12	118.3°	120.0°
C16	C17	H5	109.5°	109.4°
C16	C17	H6	109.5°	109.5°
C16	C17	H7	109.5°	109.4°
O18	C16	C12	120.9°	120.0°
C15	C13	C12	126.4°	125.5°
C15	C13	N14	125.8°	125.5°
C13	C15	H2	109.5°	109.4°
C13	C15	H3	109.5°	109.5°
C13	C15	H4	109.4°	109.5°
C16	C12	C13	124.1°	126.9°
C16	C12	C11	127.9°	126.9°
C12	C13	N14	107.9°	109.1°
C13	C12	C11	107.9°	106.2°
C13	N14	C10	110.6°	110.6°
C13	N14	H15	124.7°	124.7°
C12	C11	C19	128.4°	127.1°
C12	C11	C10	100.7°	105.8°
N14	C10	C11	112.9°	108.3°
N14	C10	C8	117.7°	125.8°
C10	N14	H15	124.7°	124.7°
C19	C11	C10	130.9°	127.1°
C11	C19	C20	120.8°	120.1°
C11	C19	C24	118.4°	120.1°
C11	C10	C8	129.3°	125.8°
C19	C20	C21	119.3°	119.8°
C20	C19	C24	120.8°	119.7°
C19	C20	H8	120.4°	120.1°
C20	C21	C22	120.0°	120.2°
C21	C20	H8	120.4°	120.1°
C20	C21	H9	120.0°	119.9°
C19	C24	C23	119.9°	119.9°
C19	C24	H12	120.1°	120.1°
C10	C8	N9	115.3°	125.1°
C10	C8	N7	130.9°	125.2°
C21	C22	C23	120.6°	120.3°
C22	C21	H9	120.0°	119.9°
C21	C22	H10	119.7°	119.9°
C24	C23	C22	119.5°	120.1°
C24	C23	H11	120.2°	119.9°
C23	C24	H12	120.1°	120.1°
C23	C22	H10	119.7°	119.8°
C22	C23	H11	120.3°	119.9°
N9	C8	N7	113.7°	109.7°
C8	N9	C2	105.2°	109.6°
C8	N7	C3	107.1°	107.1°
C8	N7	H18	126.4°	126.4°
N9	C2	C3	110.0°	107.3°
N9	C2	C1	131.5°	133.2°
N7	C3	C2	103.9°	106.2°
N7	C3	C4	133.3°	133.7°
C3	N7	H18	126.5°	126.4°
C3	C2	C1	118.5°	119.5°
C2	C3	C4	122.6°	120.1°
C2	C1	C6	118.3°	119.7°
C2	C1	H1	120.9°	120.1°
C3	C4	C5	116.6°	119.9°
C3	C4	H13	121.6°	120.0°
C1	C6	C5	123.8°	120.4°
C1	C6	N25	112.3°	119.8°
C6	C1	H1	120.9°	120.2°
C4	C5	C6	120.1°	120.4°
C5	C4	H13	121.7°	120.1°
C4	C5	H14	119.9°	119.7°
C5	C6	N25	123.8°	119.8°
C6	C5	H14	120.0°	119.8°
C6	N25	H16	109.5°	120.0°
C6	N25	H17	109.5°	120.0°
H2	C15	H3	109.5°	109.5°
H2	C15	H4	109.5°	109.4°
H3	C15	H4	109.5°	109.5°
H5	C17	H6	109.5°	109.5°
H5	C17	H7	109.5°	109.5°
H6	C17	H7	109.5°	109.5°
H16	N25	H17	109.5°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C17	C16	O18	C12	179.4°	180.0°
C17	C16	C12	C13	139.4°	91.6°
C17	C16	C12	C11	39.8°	88.3°
C16	C17	H5	H6	120.0°	120.1°
C16	C17	H5	H7	120.0°	119.9°
C16	C17	H6	H7	120.0°	120.0°
O18	C16	C12	C13	40.0°	88.4°
O18	C16	C12	C11	140.7°	91.7°
O18	C16	C17	H5	0.0°	174.7°
O18	C16	C17	H6	120.0°	54.7°
O18	C16	C17	H7	120.0°	65.3°
C15	C13	C12	C16	0.3°	0.1°
C15	C13	C12	N14	179.7°	179.7°
C15	C13	C12	C11	179.6°	180.0°
C15	C13	N14	C10	179.9°	179.9°
C13	C15	H2	H3	120.0°	120.0°
C13	C15	H2	H4	120.0°	120.0°
C13	C15	H3	H4	119.9°	120.0°
C15	C13	N14	H15	0.2°	0.3°
C16	C12	C13	C11	179.4°	180.0°
C16	C12	C13	N14	179.9°	179.7°
C16	C12	C11	C19	1.3°	0.1°
C16	C12	C11	C10	179.9°	180.0°
C12	C16	C17	H5	179.4°	5.2°
C12	C16	C17	H6	60.5°	125.3°
C12	C16	C17	H7	59.5°	114.7°
C12	C13	N14	C10	0.4°	0.5°
C13	C12	C11	C19	179.4°	180.0°
C13	C12	C11	C10	0.6°	0.1°
C12	C13	C15	H2	90.2°	89.5°
C12	C13	C15	H3	149.8°	150.5°
C12	C13	C15	H4	29.8°	30.4°
C12	C13	N14	H15	179.5°	180.0°
N14	C13	C12	C11	0.7°	0.3°
C13	N14	C10	H15	180.0°	179.5°
C13	N14	C10	C11	0.0°	0.4°
C13	N14	C10	C8	179.4°	179.8°
N14	C13	C15	H2	90.2°	90.9°
N14	C13	C15	H3	29.8°	29.1°
N14	C13	C15	H4	149.8°	149.2°
C12	C11	C10	N14	0.4°	0.2°
C12	C11	C19	C10	178.4°	179.9°
C12	C11	C19	C20	114.2°	65.2°
C12	C11	C19	C24	65.4°	115.0°
C12	C11	C10	C8	179.7°	180.0°
N14	C10	C11	C19	179.1°	179.7°
N14	C10	C11	C8	179.3°	179.8°
N14	C10	C8	N9	11.0°	179.7°
N14	C10	C8	N7	166.8°	0.2°
C11	C19	C20	C24	179.6°	179.8°
C11	C19	C20	C21	180.0°	180.0°
C19	C11	C10	C8	1.6°	0.1°
C11	C19	C24	C23	180.0°	179.7°
C11	C19	C20	H8	0.0°	0.1°
C11	C19	C24	H12	0.0°	0.0°
C10	C11	C19	C20	67.4°	114.7°
C10	C11	C19	C24	113.0°	65.1°
C11	C10	C8	N9	169.7°	0.0°
C11	C10	C8	N7	12.5°	180.0°
C11	C10	N14	H15	179.9°	180.0°
C19	C20	C21	H8	180.0°	179.9°
C19	C20	C21	C22	0.0°	0.2°
C20	C19	C24	C23	0.4°	0.5°
C19	C20	C21	H9	180.0°	180.0°
C20	C19	C24	H12	179.6°	179.8°
C21	C20	C19	C24	0.4°	0.1°
C20	C21	C22	H9	180.0°	179.9°
C20	C21	C22	C23	0.4°	0.1°
C20	C21	C22	H10	179.6°	179.9°
C19	C24	C23	H12	180.0°	179.7°
C19	C24	C23	C22	0.0°	0.6°
C24	C19	C20	H8	179.6°	179.7°
C19	C24	C23	H11	180.0°	179.8°
C10	C8	N9	N7	178.1°	180.0°
C10	C8	N9	C2	178.8°	180.0°
C10	C8	N7	C3	176.8°	180.0°
C8	C10	N14	H15	0.7°	0.2°
C10	C8	N7	H18	3.2°	0.0°
C21	C22	C23	C24	0.4°	0.3°
C21	C22	C23	H10	180.0°	180.0°
C22	C21	C20	H8	180.0°	180.0°
C21	C22	C23	H11	179.6°	179.9°
C24	C23	C22	H11	180.0°	179.6°
C24	C23	C22	H10	179.6°	179.7°
C23	C22	C21	H9	179.6°	179.9°
C22	C23	C24	H12	180.0°	179.7°
N9	C8	N7	C3	1.0°	0.0°
C8	N9	C2	C3	2.0°	0.0°
C8	N9	C2	C1	179.5°	180.0°
N9	C8	N7	H18	179.0°	180.0°
N7	C8	N9	C2	0.7°	0.0°
C8	N7	C3	H18	180.0°	180.0°
C8	N7	C3	C2	2.1°	0.0°
C8	N7	C3	C4	176.0°	180.0°
N9	C2	C3	N7	2.6°	0.0°
N9	C2	C3	C1	178.7°	180.0°
N9	C2	C3	C4	177.3°	180.0°
N9	C2	C1	C6	179.4°	180.0°
N9	C2	C1	H1	0.6°	0.2°
N7	C3	C2	C4	174.7°	180.0°
N7	C3	C2	C1	178.7°	180.0°
N7	C3	C4	C5	176.3°	180.0°
N7	C3	C4	H13	3.6°	0.0°
C3	C2	C1	C6	2.2°	0.1°
C2	C3	C4	C5	3.4°	0.0°
C3	C2	C1	H1	177.8°	179.7°
C2	C3	C4	H13	176.6°	180.0°
C2	C3	N7	H18	177.9°	180.0°
C1	C2	C3	C4	3.9°	0.1°
C2	C1	C6	H1	180.0°	179.8°
C2	C1	C6	C5	0.3°	0.0°
C2	C1	C6	N25	179.6°	179.7°
C3	C4	C5	H13	180.0°	180.0°
C3	C4	C5	C6	1.3°	0.0°
C3	C4	C5	H14	178.7°	180.0°
C4	C3	N7	H18	4.0°	0.0°
C1	C6	C5	C4	0.3°	0.0°
C1	C6	C5	N25	179.8°	179.7°
C1	C6	C5	H14	179.7°	180.0°
C1	C6	N25	H16	180.0°	0.1°
C1	C6	N25	H17	60.0°	180.0°
C4	C5	C6	H14	180.0°	179.9°
C4	C5	C6	N25	179.9°	179.7°
C5	C6	C1	H1	179.8°	179.8°
C6	C5	C4	H13	178.7°	180.0°
C5	C6	N25	H16	0.1°	179.8°
C5	C6	N25	H17	119.9°	0.3°
N25	C6	C1	H1	0.4°	0.1°
N25	C6	C5	H14	0.2°	0.3°
C6	N25	H16	H17	120.0°	179.9°
H2	C15	H3	H4	120.0°	120.0°
H5	C17	H6	H7	120.0°	120.0°
H8	C20	C21	H9	0.1°	0.1°
H9	C21	C22	H10	0.4°	0.1°
H10	C22	C23	H11	0.4°	0.1°
H11	C23	C24	H12	0.0°	0.1°
H13	C4	C5	H14	1.3°	0.0°

Release date:	2022-04-06
Definition date:	2021-04-06
Last modified:	2022-04-01
Release status:	REL
Processing site:	PDBJ
Derived from:	7EIG