FQM

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N26	C19	sing	1.39Å	1.39Å
C19	C10	doub	1.39Å	1.38Å	Aromatic
C19	N23	sing	1.32Å	1.34Å	Aromatic
C10	C4	sing	1.38Å	1.38Å	Aromatic
C2	C6	doub	1.38Å	1.38Å	Aromatic
C2	C1	sing	1.38Å	1.39Å	Aromatic
N23	C17	doub	1.33Å	1.34Å	Aromatic
C6	C15	sing	1.39Å	1.38Å	Aromatic
C1	C3	doub	1.38Å	1.38Å	Aromatic
C4	C9	doub	1.39Å	1.38Å	Aromatic
C15	N25	sing	1.40Å	1.41Å
C15	C7	doub	1.39Å	1.38Å	Aromatic
C3	C7	sing	1.38Å	1.38Å	Aromatic
N24	N25	sing	1.40Å	1.34Å	Aromatic
N24	C18	doub	1.32Å	1.34Å	Aromatic
C17	C9	sing	1.39Å	1.38Å	Aromatic
C17	C13	sing	1.48Å	1.46Å
N25	C20	sing	1.36Å	1.37Å	Aromatic
N27	C22	sing	1.35Å	1.37Å
C18	C22	sing	1.48Å	1.44Å
C18	C12	sing	1.41Å	1.41Å	Aromatic
C22	O30	doub	1.22Å	1.22Å
C20	N28	sing	1.39Å	1.37Å
C20	C12	doub	1.36Å	1.37Å	Aromatic
N28	C21	sing	1.35Å	1.36Å
C11	C13	doub	1.39Å	1.39Å	Aromatic
C11	C14	sing	1.39Å	1.39Å	Aromatic
C13	C5	sing	1.39Å	1.39Å	Aromatic
C14	C21	sing	1.48Å	1.49Å
C14	C16	doub	1.40Å	1.38Å	Aromatic
C21	O29	doub	1.22Å	1.22Å
C5	C8	doub	1.38Å	1.38Å	Aromatic
C16	C8	sing	1.38Å	1.38Å	Aromatic
C16	CL1	sing	1.74Å	1.73Å
C1	H1	sing	1.08Å	1.08Å
C2	H2	sing	1.08Å	1.08Å
C3	H3	sing	1.08Å	1.08Å
C4	H4	sing	1.08Å	1.08Å
C5	H5	sing	1.08Å	1.08Å
C6	H6	sing	1.08Å	1.08Å
C7	H7	sing	1.08Å	1.08Å
C8	H8	sing	1.08Å	1.08Å
C9	H9	sing	1.08Å	1.08Å
C10	H10	sing	1.08Å	1.08Å
C11	H11	sing	1.08Å	1.08Å
C12	H12	sing	1.08Å	1.08Å
N26	H13	sing	0.97Å	1.00Å
N26	H14	sing	0.97Å	1.00Å
N27	H15	sing	0.97Å	1.00Å
N27	H16	sing	0.97Å	1.00Å
N28	H17	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N26	C19	C10	119.0°	119.6°
N26	C19	N23	117.9°	119.7°
C19	N26	H13	109.5°	120.1°
C19	N26	H14	109.5°	120.0°
C10	C19	N23	123.1°	120.7°
C19	C10	C4	117.9°	119.3°
C19	C10	H10	121.0°	120.3°
C19	N23	C17	119.0°	121.5°
C10	C4	C9	119.3°	118.6°
C10	C4	H4	120.4°	120.7°
C4	C10	H10	121.0°	120.4°
C6	C2	C1	118.9°	120.1°
C2	C6	C15	120.7°	119.9°
C6	C2	H2	120.6°	120.0°
C2	C6	H6	119.7°	120.0°
C2	C1	C3	120.2°	120.1°
C2	C1	H1	119.9°	120.0°
C1	C2	H2	120.5°	119.9°
N23	C17	C9	121.2°	120.6°
N23	C17	C13	115.6°	119.7°
C6	C15	N25	119.5°	120.0°
C6	C15	C7	120.6°	119.9°
C15	C6	H6	119.6°	120.1°
C1	C3	C7	120.8°	120.1°
C3	C1	H1	119.9°	119.9°
C1	C3	H3	119.6°	120.0°
C4	C9	C17	119.5°	119.2°
C9	C4	H4	120.4°	120.7°
C4	C9	H9	120.2°	120.4°
N25	C15	C7	119.9°	120.1°
C15	N25	N24	120.9°	126.0°
C15	N25	C20	127.9°	125.9°
C15	C7	C3	118.8°	119.9°
C15	C7	H7	120.6°	120.0°
C7	C3	H3	119.6°	119.9°
C3	C7	H7	120.6°	120.1°
N25	N24	C18	105.6°	108.3°
N24	N25	C20	111.2°	108.0°
N24	C18	C22	120.4°	125.9°
N24	C18	C12	111.5°	108.1°
C9	C17	C13	123.2°	119.6°
C17	C9	H9	120.3°	120.4°
C17	C13	C11	122.8°	120.0°
C17	C13	C5	119.6°	120.1°
N25	C20	N28	124.9°	126.1°
N25	C20	C12	107.6°	107.7°
N27	C22	C18	113.4°	120.0°
N27	C22	O30	124.7°	120.0°
C22	N27	H15	120.0°	119.9°
C22	N27	H16	120.0°	120.0°
C22	C18	C12	128.1°	125.9°
C18	C22	O30	121.8°	120.0°
C18	C12	C20	104.1°	107.8°
C18	C12	H12	127.9°	126.1°
N28	C20	C12	127.5°	126.1°
C20	N28	C21	118.8°	120.0°
C20	N28	H17	120.6°	120.0°
C20	C12	H12	127.9°	126.1°
N28	C21	C14	114.8°	120.0°
N28	C21	O29	124.7°	120.0°
C21	N28	H17	120.6°	120.0°
C13	C11	C14	121.2°	119.7°
C11	C13	C5	117.6°	119.9°
C13	C11	H11	119.4°	120.1°
C11	C14	C21	120.1°	120.1°
C11	C14	C16	120.0°	119.8°
C14	C11	H11	119.4°	120.1°
C13	C5	C8	121.7°	120.2°
C13	C5	H5	119.1°	119.9°
C21	C14	C16	119.8°	120.1°
C14	C21	O29	120.4°	120.0°
C14	C16	C8	119.6°	120.1°
C14	C16	CL1	122.0°	120.0°
C5	C8	C16	119.8°	120.3°
C8	C5	H5	119.1°	119.9°
C5	C8	H8	120.1°	119.8°
C8	C16	CL1	118.4°	120.0°
C16	C8	H8	120.1°	119.9°
H13	N26	H14	109.4°	119.9°
H15	N27	H16	120.0°	120.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N26	C19	C10	N23	180.0°	179.5°
N26	C19	C10	C4	179.7°	180.0°
N26	C19	N23	C17	179.8°	179.7°
N26	C19	C10	H10	0.3°	0.0°
C19	N26	H13	H14	120.0°	180.0°
C19	C10	C4	H10	180.0°	179.9°
C10	C19	N23	C17	0.1°	0.8°
C19	C10	C4	C9	0.4°	0.1°
C19	C10	C4	H4	179.6°	179.7°
C10	C19	N26	H13	180.0°	0.1°
C10	C19	N26	H14	60.0°	180.0°
N23	C19	C10	C4	0.3°	0.5°
C19	N23	C17	C9	0.1°	0.5°
C19	N23	C17	C13	179.8°	179.5°
N23	C19	C10	H10	179.7°	179.5°
N23	C19	N26	H13	0.0°	179.4°
N23	C19	N26	H14	120.0°	0.5°
C10	C4	C9	H4	180.0°	179.8°
C10	C4	C9	C17	0.3°	0.2°
C10	C4	C9	H9	179.7°	179.8°
C6	C2	C1	H2	180.0°	179.9°
C2	C6	C15	H6	180.0°	179.9°
C6	C2	C1	C3	0.5°	0.0°
C2	C6	C15	N25	179.0°	180.0°
C2	C6	C15	C7	2.1°	0.3°
C6	C2	C1	H1	179.5°	179.8°
C1	C2	C6	C15	1.0°	0.1°
C2	C1	C3	H1	180.0°	179.7°
C2	C1	C3	C7	0.9°	0.3°
C2	C1	C3	H3	179.1°	179.7°
C1	C2	C6	H6	179.0°	180.0°
N23	C17	C9	C4	0.1°	0.0°
N23	C17	C9	C13	179.9°	180.0°
N23	C17	C13	C11	39.2°	0.0°
N23	C17	C13	C5	141.5°	180.0°
N23	C17	C9	H9	179.9°	180.0°
C6	C15	N25	C7	178.9°	179.7°
C6	C15	C7	C3	1.7°	0.6°
C6	C15	N25	N24	132.6°	35.0°
C6	C15	N25	C20	45.4°	145.1°
C15	C6	C2	H2	179.0°	180.0°
C6	C15	C7	H7	178.3°	180.0°
C1	C3	C7	C15	0.2°	0.5°
C1	C3	C7	H3	180.0°	179.9°
C3	C1	C2	H2	179.5°	179.9°
C1	C3	C7	H7	179.8°	180.0°
C4	C9	C17	H9	180.0°	180.0°
C4	C9	C17	C13	179.7°	180.0°
C9	C4	C10	H10	179.6°	180.0°
N25	C15	C7	C3	179.4°	179.7°
C15	N25	N24	C20	178.3°	179.9°
C15	N25	N24	C18	178.6°	179.9°
C15	N25	C20	N28	0.2°	0.1°
C15	N25	C20	C12	178.5°	179.9°
N25	C15	C6	H6	1.0°	0.0°
N25	C15	C7	H7	0.6°	0.3°
C15	C7	C3	H7	180.0°	179.5°
C7	C15	N25	N24	46.4°	144.7°
C7	C15	N25	C20	135.7°	35.2°
C15	C7	C3	H3	179.8°	179.4°
C7	C15	C6	H6	177.9°	179.7°
C7	C3	C1	H1	179.1°	180.0°
N25	N24	C18	C22	179.2°	179.8°
N25	N24	C18	C12	0.1°	0.2°
N24	N25	C20	N28	178.3°	179.9°
N24	N25	C20	C12	0.4°	0.2°
C18	N24	N25	C20	0.3°	0.0°
N24	C18	C22	N27	160.2°	0.1°
N24	C18	C22	C12	179.0°	180.0°
N24	C18	C22	O30	16.1°	180.0°
N24	C18	C12	C20	0.1°	0.3°
N24	C18	C12	H12	179.9°	180.0°
C9	C17	C13	C11	141.0°	180.0°
C9	C17	C13	C5	38.4°	0.0°
C17	C9	C4	H4	179.7°	179.9°
C17	C13	C11	C5	179.4°	180.0°
C17	C13	C11	C14	178.9°	179.5°
C17	C13	C5	C8	178.0°	179.9°
C17	C13	C5	H5	2.0°	0.3°
C13	C17	C9	H9	0.3°	0.0°
C17	C13	C11	H11	1.1°	0.0°
N25	C20	C12	C18	0.3°	0.3°
N25	C20	N28	C12	178.4°	179.9°
N25	C20	N28	C21	91.3°	179.9°
N25	C20	C12	H12	179.7°	180.0°
N25	C20	N28	H17	88.7°	0.0°
N27	C22	C18	O30	176.3°	179.9°
N27	C22	C18	C12	18.8°	179.9°
C22	N27	H15	H16	180.0°	179.9°
C22	C18	C12	C20	178.9°	179.7°
C22	C18	C12	H12	1.1°	0.1°
C18	C22	N27	H15	176.2°	0.1°
C18	C22	N27	H16	3.8°	180.0°
C12	C18	C22	O30	164.9°	0.0°
C18	C12	C20	N28	178.4°	179.8°
C18	C12	C20	H12	180.0°	179.6°
O30	C22	N27	H15	0.0°	180.0°
O30	C22	N27	H16	180.0°	0.1°
C20	N28	C21	H17	180.0°	180.0°
C20	N28	C21	C14	173.6°	180.0°
C20	N28	C21	O29	4.7°	0.0°
N28	C20	C12	H12	1.7°	0.1°
C12	C20	N28	C21	90.3°	0.0°
C12	C20	N28	H17	89.7°	180.0°
N28	C21	C14	C11	56.8°	0.0°
N28	C21	C14	O29	178.3°	180.0°
N28	C21	C14	C16	126.2°	179.2°
C13	C11	C14	H11	180.0°	179.5°
C13	C11	C14	C21	177.7°	180.0°
C13	C11	C14	C16	0.7°	0.8°
C11	C13	C5	C8	1.4°	0.1°
C11	C13	C5	H5	178.6°	179.7°
C14	C11	C13	C5	0.5°	0.5°
C11	C14	C21	C16	177.0°	179.2°
C11	C14	C21	O29	121.6°	180.0°
C11	C14	C16	C8	1.1°	0.5°
C11	C14	C16	CL1	179.0°	180.0°
C13	C5	C8	H5	180.0°	179.6°
C13	C5	C8	C16	1.0°	0.4°
C13	C5	C8	H8	179.0°	179.8°
C5	C13	C11	H11	179.5°	180.0°
C21	C14	C16	C8	178.1°	179.7°
C21	C14	C16	CL1	4.0°	0.8°
C21	C14	C11	H11	2.3°	0.5°
C14	C21	N28	H17	6.4°	0.0°
C16	C14	C21	O29	55.5°	0.8°
C14	C16	C8	C5	0.2°	0.1°
C14	C16	C8	CL1	178.0°	179.5°
C14	C16	C8	H8	179.8°	180.0°
C16	C14	C11	H11	179.3°	179.7°
O29	C21	N28	H17	175.3°	180.0°
C5	C8	C16	H8	180.0°	179.9°
C5	C8	C16	CL1	178.3°	179.4°
C16	C8	C5	H5	179.0°	180.0°
CL1	C16	C8	H8	1.7°	0.5°
H1	C1	C2	H2	0.5°	0.4°
H1	C1	C3	H3	0.9°	0.1°
H2	C2	C6	H6	1.0°	0.1°
H3	C3	C7	H7	0.2°	0.1°
H4	C4	C9	H9	0.3°	0.0°
H4	C4	C10	H10	0.4°	0.2°
H5	C5	C8	H8	1.0°	0.1°

Release date:	2018-05-02
Definition date:	2018-04-13
Last modified:	2018-04-27
Release status:	REL
Processing site:	RCSB
Derived from:	6D1Z