RKA

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.40Å	1.38Å	Aromatic
C1	C5	doub	1.37Å	1.41Å	Aromatic
C1	H1	sing	1.08Å	1.08Å
C2	C3	doub	1.36Å	1.41Å	Aromatic
C2	H2	sing	1.08Å	1.08Å
C3	N4	sing	1.37Å	1.41Å	Aromatic
C3	C6	sing	1.48Å	1.42Å	Aromatic
N4	C5	sing	1.37Å	1.40Å	Aromatic
N4	HN4	sing	0.97Å	1.00Å
C5	C12	sing	1.48Å	1.43Å	Aromatic
C6	C7	sing	1.40Å	1.41Å	Aromatic
C6	C11	doub	1.40Å	1.41Å	Aromatic
C7	C8	doub	1.38Å	1.39Å	Aromatic
C7	H7	sing	1.08Å	1.08Å
C8	C9	sing	1.39Å	1.40Å	Aromatic
C8	H8	sing	1.08Å	1.08Å
C9	C10	doub	1.39Å	1.39Å	Aromatic
C9	N27	sing	1.40Å	1.46Å
C10	C11	sing	1.38Å	1.39Å	Aromatic
C10	H10	sing	1.08Å	1.08Å
C11	H11	sing	1.08Å	1.08Å
C12	C13	doub	1.40Å	1.41Å	Aromatic
C12	C17	sing	1.40Å	1.41Å	Aromatic
C13	C14	sing	1.38Å	1.38Å	Aromatic
C13	H13	sing	1.08Å	1.08Å
C14	C15	doub	1.39Å	1.40Å	Aromatic
C14	H14	sing	1.08Å	1.08Å
C15	C16	sing	1.39Å	1.39Å	Aromatic
C15	N18	sing	1.40Å	1.46Å
C16	C17	doub	1.38Å	1.39Å	Aromatic
C16	H16	sing	1.08Å	1.08Å
C17	H17	sing	1.08Å	1.08Å
N18	C19	sing	1.38Å	1.45Å
N18	HN18	sing	0.97Å	1.00Å
C19	N20	doub	1.30Å	1.27Å
C19	C21	sing	1.48Å	1.52Å
N20	HN20	sing	0.97Å	1.00Å
C21	C22	doub	1.40Å	1.40Å	Aromatic
C21	C26	sing	1.39Å	1.40Å	Aromatic
C22	C23	sing	1.38Å	1.39Å	Aromatic
C22	H22	sing	1.08Å	1.08Å
C23	C24	doub	1.38Å	1.40Å	Aromatic
C23	H23	sing	1.08Å	1.08Å
C24	C25	sing	1.38Å	1.40Å	Aromatic
C24	H24	sing	1.08Å	1.08Å
C25	C26	doub	1.38Å	1.39Å	Aromatic
C25	H25	sing	1.08Å	1.08Å
C26	H26	sing	1.08Å	1.08Å
N27	C28	sing	1.38Å	1.45Å
N27	HN27	sing	0.97Å	1.00Å
C28	N29	doub	1.30Å	1.27Å
C28	C30	sing	1.48Å	1.52Å
N29	HN29	sing	0.97Å	1.00Å
C30	C31	doub	1.39Å	1.40Å	Aromatic
C30	C35	sing	1.39Å	1.40Å	Aromatic
C31	C32	sing	1.38Å	1.39Å	Aromatic
C31	H31	sing	1.08Å	1.08Å
C32	C33	doub	1.38Å	1.39Å	Aromatic
C32	H32	sing	1.08Å	1.08Å
C33	C34	sing	1.38Å	1.39Å	Aromatic
C33	H33	sing	1.08Å	1.08Å
C34	C35	doub	1.38Å	1.39Å	Aromatic
C34	H34	sing	1.08Å	1.08Å
C35	H35	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	C5	108.6°	107.6°
C2	C1	H1	125.7°	126.2°
C1	C2	C3	108.3°	107.6°
C1	C2	H2	125.8°	126.1°
C5	C1	H1	125.7°	126.2°
C1	C5	N4	107.7°	108.1°
C1	C5	C12	126.7°	125.9°
C3	C2	H2	125.9°	126.2°
C2	C3	N4	107.9°	108.1°
C2	C3	C6	128.6°	125.9°
N4	C3	C6	123.4°	126.0°
C3	N4	C5	107.5°	108.5°
C3	N4	HN4	126.3°	125.8°
C3	C6	C7	122.5°	120.0°
C3	C6	C11	119.8°	120.1°
C5	N4	HN4	126.3°	125.8°
N4	C5	C12	125.6°	126.0°
C5	C12	C13	119.6°	120.1°
C5	C12	C17	123.2°	120.0°
C7	C6	C11	117.7°	119.9°
C6	C7	C8	120.7°	119.9°
C6	C7	H7	119.6°	120.1°
C6	C11	C10	121.8°	120.0°
C6	C11	H11	119.1°	120.0°
C8	C7	H7	119.6°	120.0°
C7	C8	C9	120.5°	120.1°
C7	C8	H8	119.7°	120.0°
C9	C8	H8	119.7°	120.0°
C8	C9	C10	119.9°	120.2°
C8	C9	N27	123.3°	119.9°
C10	C9	N27	116.8°	119.9°
C9	C10	C11	119.4°	120.1°
C9	C10	H10	120.3°	119.9°
C9	N27	C28	135.9°	120.0°
C9	N27	HN27	112.1°	120.0°
C11	C10	H10	120.3°	120.0°
C10	C11	H11	119.1°	120.0°
C13	C12	C17	117.1°	119.8°
C12	C13	C14	121.0°	120.0°
C12	C13	H13	119.5°	120.0°
C12	C17	C16	121.8°	119.9°
C12	C17	H17	119.1°	120.1°
C14	C13	H13	119.5°	120.0°
C13	C14	C15	121.0°	120.1°
C13	C14	H14	119.5°	120.0°
C15	C14	H14	119.5°	120.0°
C14	C15	C16	119.1°	120.2°
C14	C15	N18	122.2°	120.0°
C16	C15	N18	118.7°	119.9°
C15	C16	C17	119.9°	120.1°
C15	C16	H16	120.0°	120.0°
C15	N18	C19	131.5°	120.0°
C15	N18	HN18	114.2°	120.0°
C17	C16	H16	120.1°	120.0°
C16	C17	H17	119.1°	120.0°
C19	N18	HN18	114.3°	120.0°
N18	C19	N20	121.5°	120.0°
N18	C19	C21	118.5°	120.0°
N20	C19	C21	120.0°	120.0°
C19	N20	HN20	106.6°	120.0°
C19	C21	C22	120.1°	120.1°
C19	C21	C26	120.1°	120.1°
C22	C21	C26	119.7°	119.7°
C21	C22	C23	120.1°	119.9°
C21	C22	H22	119.9°	120.1°
C21	C26	C25	119.8°	119.9°
C21	C26	H26	120.1°	120.1°
C23	C22	H22	120.0°	120.1°
C22	C23	C24	120.0°	120.1°
C22	C23	H23	120.0°	120.0°
C24	C23	H23	120.0°	119.9°
C23	C24	C25	119.9°	120.3°
C23	C24	H24	120.0°	119.9°
C25	C24	H24	120.1°	119.8°
C24	C25	C26	120.4°	120.1°
C24	C25	H25	119.8°	119.9°
C26	C25	H25	119.8°	120.0°
C25	C26	H26	120.1°	120.0°
C28	N27	HN27	112.1°	120.1°
N27	C28	N29	124.5°	120.0°
N27	C28	C30	117.0°	120.0°
N29	C28	C30	118.5°	120.0°
C28	N29	HN29	110.8°	120.0°
C28	C30	C31	119.7°	120.1°
C28	C30	C35	120.2°	120.2°
C31	C30	C35	120.1°	119.7°
C30	C31	C32	120.2°	119.8°
C30	C31	H31	119.9°	120.1°
C30	C35	C34	119.4°	119.9°
C30	C35	H35	120.3°	120.1°
C32	C31	H31	119.9°	120.1°
C31	C32	C33	119.3°	120.2°
C31	C32	H32	120.4°	119.9°
C33	C32	H32	120.3°	120.0°
C32	C33	C34	120.8°	120.3°
C32	C33	H33	119.6°	119.9°
C34	C33	H33	119.6°	119.8°
C33	C34	C35	120.2°	120.1°
C33	C34	H34	119.9°	120.0°
C35	C34	H34	119.9°	120.0°
C34	C35	H35	120.3°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	C5	H1	180.0°	179.6°
C1	C2	C3	H2	180.0°	179.8°
C1	C2	C3	N4	0.4°	0.2°
C1	C2	C3	C6	179.7°	179.8°
C2	C1	C5	N4	0.1°	0.4°
C2	C1	C5	C12	179.2°	179.9°
C5	C1	C2	C3	0.3°	0.4°
C5	C1	C2	H2	179.7°	179.8°
C1	C5	N4	C3	0.1°	0.2°
C1	C5	N4	C12	179.3°	179.8°
C1	C5	N4	HN4	179.9°	179.8°
C1	C5	C12	C13	3.0°	40.0°
C1	C5	C12	C17	176.9°	140.0°
H1	C1	C2	C3	179.7°	180.0°
H1	C1	C2	H2	0.3°	0.2°
H1	C1	C5	N4	179.9°	180.0°
H1	C1	C5	C12	0.9°	0.2°
C2	C3	N4	C6	180.0°	179.9°
C2	C3	N4	C5	0.3°	0.0°
C2	C3	N4	HN4	179.7°	180.0°
C2	C3	C6	C7	4.2°	140.0°
C2	C3	C6	C11	175.5°	39.8°
H2	C2	C3	N4	179.6°	180.0°
H2	C2	C3	C6	0.3°	0.0°
C3	N4	C5	HN4	180.0°	180.0°
C3	N4	C5	C12	179.4°	180.0°
N4	C3	C6	C7	175.8°	40.0°
N4	C3	C6	C11	4.4°	140.2°
C6	C3	N4	C5	179.7°	180.0°
C6	C3	N4	HN4	0.2°	0.1°
C3	C6	C7	C11	179.7°	179.8°
C3	C6	C7	C8	179.9°	179.7°
C3	C6	C7	H7	0.1°	0.2°
C3	C6	C11	C10	179.8°	180.0°
C3	C6	C11	H11	0.2°	0.1°
N4	C5	C12	C13	176.1°	140.3°
N4	C5	C12	C17	3.9°	39.8°
HN4	N4	C5	C12	0.6°	0.0°
C5	C12	C13	C17	180.0°	180.0°
C5	C12	C13	C14	179.9°	180.0°
C5	C12	C13	H13	0.1°	0.0°
C5	C12	C17	C16	179.9°	179.8°
C5	C12	C17	H17	0.1°	0.0°
C6	C7	C8	H7	180.0°	179.5°
C6	C7	C8	C9	0.2°	0.5°
C6	C7	C8	H8	179.8°	179.7°
C7	C6	C11	C10	0.0°	0.2°
C7	C6	C11	H11	179.9°	179.7°
C11	C6	C7	C8	0.2°	0.5°
C11	C6	C7	H7	179.8°	180.0°
C6	C11	C10	C9	0.1°	0.1°
C6	C11	C10	H11	180.0°	179.9°
C6	C11	C10	H10	179.9°	180.0°
C7	C8	C9	H8	180.0°	179.8°
C7	C8	C9	C10	0.1°	0.2°
C7	C8	C9	N27	180.0°	179.7°
H7	C7	C8	C9	179.8°	180.0°
H7	C7	C8	H8	0.2°	0.2°
C8	C9	C10	N27	180.0°	179.9°
C8	C9	C10	C11	0.1°	0.1°
C8	C9	C10	H10	179.9°	180.0°
C8	C9	N27	C28	125.6°	33.3°
C8	C9	N27	HN27	54.3°	146.6°
H8	C8	C9	C10	179.9°	180.0°
H8	C8	C9	N27	0.0°	0.1°
C9	C10	C11	H10	180.0°	179.9°
C9	C10	C11	H11	179.9°	180.0°
C10	C9	N27	C28	54.4°	146.7°
C10	C9	N27	HN27	125.6°	33.3°
N27	C9	C10	C11	179.9°	180.0°
N27	C9	C10	H10	0.2°	0.1°
C9	N27	C28	HN27	180.0°	179.9°
C9	N27	C28	N29	13.8°	5.6°
C9	N27	C28	C30	166.1°	174.5°
H10	C10	C11	H11	0.1°	0.1°
C12	C13	C14	H13	180.0°	180.0°
C12	C13	C14	C15	0.2°	0.0°
C12	C13	C14	H14	179.8°	180.0°
C13	C12	C17	C16	0.1°	0.2°
C13	C12	C17	H17	179.9°	180.0°
C17	C12	C13	C14	0.1°	0.0°
C17	C12	C13	H13	179.9°	180.0°
C12	C17	C16	C15	0.3°	0.5°
C12	C17	C16	H17	180.0°	179.8°
C12	C17	C16	H16	179.8°	180.0°
C13	C14	C15	H14	180.0°	180.0°
C13	C14	C15	C16	0.0°	0.3°
C13	C14	C15	N18	179.9°	180.0°
H13	C13	C14	C15	179.8°	180.0°
H13	C13	C14	H14	0.2°	0.0°
C14	C15	C16	N18	179.9°	179.8°
C14	C15	C16	C17	0.2°	0.5°
C14	C15	C16	H16	179.8°	180.0°
C14	C15	N18	C19	141.9°	146.0°
C14	C15	N18	HN18	38.1°	34.0°
H14	C14	C15	C16	180.0°	179.8°
H14	C14	C15	N18	0.1°	0.0°
C15	C16	C17	H16	180.0°	179.5°
C15	C16	C17	H17	179.7°	179.8°
C16	C15	N18	C19	38.0°	34.2°
C16	C15	N18	HN18	142.0°	145.8°
N18	C15	C16	C17	179.9°	179.7°
N18	C15	C16	H16	0.1°	0.2°
C15	N18	C19	HN18	180.0°	180.0°
C15	N18	C19	N20	10.1°	5.2°
C15	N18	C19	C21	169.9°	174.8°
H16	C16	C17	H17	0.2°	0.2°
N18	C19	N20	C21	180.0°	180.0°
N18	C19	N20	HN20	0.0°	180.0°
N18	C19	C21	C22	147.6°	180.0°
N18	C19	C21	C26	31.9°	0.2°
HN18	N18	C19	N20	169.9°	174.8°
HN18	N18	C19	C21	10.1°	5.2°
N20	C19	C21	C22	32.4°	0.0°
N20	C19	C21	C26	148.1°	179.8°
C21	C19	N20	HN20	180.0°	0.0°
C19	C21	C22	C26	179.5°	179.8°
C19	C21	C22	C23	180.0°	180.0°
C19	C21	C22	H22	0.0°	0.1°
C19	C21	C26	C25	179.9°	179.7°
C19	C21	C26	H26	0.1°	0.3°
C21	C22	C23	H22	180.0°	179.9°
C21	C22	C23	C24	0.1°	0.1°
C21	C22	C23	H23	179.9°	180.0°
C22	C21	C26	C25	0.3°	0.5°
C22	C21	C26	H26	179.6°	179.9°
C26	C21	C22	C23	0.5°	0.2°
C26	C21	C22	H22	179.5°	179.7°
C21	C26	C25	C24	0.3°	0.6°
C21	C26	C25	H26	180.0°	179.4°
C21	C26	C25	H25	179.7°	179.7°
C22	C23	C24	H23	180.0°	179.9°
C22	C23	C24	C25	0.8°	0.1°
C22	C23	C24	H24	179.2°	179.9°
H22	C22	C23	C24	179.9°	180.0°
H22	C22	C23	H23	0.1°	0.1°
C23	C24	C25	H24	180.0°	180.0°
C23	C24	C25	C26	0.9°	0.3°
C23	C24	C25	H25	179.1°	180.0°
H23	C23	C24	C25	179.2°	180.0°
H23	C23	C24	H24	0.8°	0.0°
C24	C25	C26	H25	180.0°	179.7°
C24	C25	C26	H26	179.7°	180.0°
H24	C24	C25	C26	179.1°	179.7°
H24	C24	C25	H25	0.9°	0.0°
H25	C25	C26	H26	0.3°	0.3°
N27	C28	N29	C30	180.0°	179.9°
N27	C28	N29	HN29	180.0°	180.0°
N27	C28	C30	C31	42.2°	180.0°
N27	C28	C30	C35	137.7°	0.2°
HN27	N27	C28	N29	166.2°	174.5°
HN27	N27	C28	C30	13.8°	5.4°
N29	C28	C30	C31	137.8°	0.1°
N29	C28	C30	C35	42.3°	179.7°
C30	C28	N29	HN29	0.1°	0.1°
C28	C30	C31	C35	179.9°	179.8°
C28	C30	C31	C32	180.0°	180.0°
C28	C30	C31	H31	0.1°	0.0°
C28	C30	C35	C34	180.0°	179.7°
C28	C30	C35	H35	0.0°	0.1°
C30	C31	C32	H31	180.0°	180.0°
C30	C31	C32	C33	0.0°	0.1°
C30	C31	C32	H32	180.0°	180.0°
C31	C30	C35	C34	0.1°	0.5°
C31	C30	C35	H35	179.9°	180.0°
C35	C30	C31	C32	0.0°	0.2°
C35	C30	C31	H31	180.0°	179.8°
C30	C35	C34	C33	0.1°	0.5°
C30	C35	C34	H35	180.0°	179.6°
C30	C35	C34	H34	179.9°	179.7°
C31	C32	C33	H32	180.0°	179.9°
C31	C32	C33	C34	0.0°	0.0°
C31	C32	C33	H33	179.9°	179.9°
H31	C31	C32	C33	179.9°	180.0°
H31	C31	C32	H32	0.0°	0.0°
C32	C33	C34	H33	180.0°	179.9°
C32	C33	C34	C35	0.0°	0.3°
C32	C33	C34	H34	180.0°	180.0°
H32	C32	C33	C34	180.0°	179.9°
H32	C32	C33	H33	0.0°	0.1°
C33	C34	C35	H34	180.0°	179.7°
C33	C34	C35	H35	179.9°	179.9°
H33	C33	C34	C35	180.0°	179.8°
H33	C33	C34	H34	0.0°	0.1°
H34	C34	C35	H35	0.1°	0.2°

Definition date:	2006-05-11
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB