0Y4

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N29	C28	doub	1.31Å	1.31Å	Aromatic
N29	C25	sing	1.34Å	1.37Å	Aromatic
C28	N27	sing	1.35Å	1.36Å	Aromatic
C25	N24	sing	1.40Å	1.36Å
C25	C26	doub	1.35Å	1.38Å	Aromatic
N27	C30	sing	1.47Å	1.44Å
N27	C26	sing	1.37Å	1.36Å	Aromatic
N24	C15	sing	1.38Å	1.38Å
N21	C20	doub	1.31Å	1.33Å	Aromatic
N21	N16	sing	1.40Å	1.34Å	Aromatic
C20	C19	sing	1.41Å	1.41Å	Aromatic
N16	C15	sing	1.37Å	1.37Å	Aromatic
N16	C17	sing	1.37Å	1.37Å	Aromatic
C15	C14	doub	1.37Å	1.34Å	Aromatic
C19	C17	doub	1.41Å	1.38Å	Aromatic
C19	C22	sing	1.43Å	1.42Å
C17	N18	sing	1.33Å	1.35Å	Aromatic
C14	C13	sing	1.40Å	1.48Å	Aromatic
C22	N23	trip	1.14Å	1.16Å
N18	C13	doub	1.33Å	1.31Å	Aromatic
C13	N12	sing	1.38Å	1.38Å
N12	C5	sing	1.40Å	1.41Å
C5	C6	doub	1.39Å	1.38Å	Aromatic
C5	C4	sing	1.39Å	1.38Å	Aromatic
C6	C7	sing	1.39Å	1.38Å	Aromatic
C11	C9	sing	1.51Å	1.50Å
C4	C3	doub	1.38Å	1.39Å	Aromatic
C9	O10	doub	1.21Å	1.22Å
C9	N8	sing	1.35Å	1.39Å
C7	N8	sing	1.40Å	1.40Å
C7	C2	doub	1.39Å	1.39Å	Aromatic
C3	C2	sing	1.38Å	1.38Å	Aromatic
C2	C1	sing	1.51Å	1.50Å
C1	H1	sing	1.09Å	1.10Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C3	H4	sing	1.08Å	1.08Å
C11	H5	sing	1.09Å	1.10Å
C11	H6	sing	1.09Å	1.10Å
C11	H7	sing	1.09Å	1.10Å
C14	H8	sing	1.08Å	1.08Å
C20	H9	sing	1.08Å	1.08Å
C30	H10	sing	1.09Å	1.10Å
C30	H11	sing	1.09Å	1.10Å
C30	H12	sing	1.09Å	1.10Å
C4	H13	sing	1.08Å	1.08Å
C6	H14	sing	1.08Å	1.08Å
N8	H15	sing	0.97Å	1.00Å
N12	H16	sing	0.97Å	1.00Å
N24	H17	sing	0.97Å	1.00Å
C26	H18	sing	1.08Å	1.08Å
C28	H19	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C28	N29	C25	105.0°	109.3°
N29	C28	N27	110.7°	108.9°
N29	C28	H19	124.6°	125.5°
N29	C25	N24	121.7°	126.0°
N29	C25	C26	111.7°	107.9°
C28	N27	C30	125.3°	126.4°
C28	N27	C26	109.0°	107.2°
N27	C28	H19	124.6°	125.6°
N24	C25	C26	126.6°	126.0°
C25	N24	C15	124.1°	120.0°
C25	N24	H17	117.9°	120.0°
C25	C26	N27	103.6°	106.7°
C25	C26	H18	128.2°	126.7°
C30	N27	C26	125.7°	126.4°
N27	C30	H10	109.5°	109.5°
N27	C30	H11	109.5°	109.5°
N27	C30	H12	109.5°	109.5°
N27	C26	H18	128.2°	126.6°
N24	C15	N16	115.5°	120.5°
N24	C15	C14	125.7°	120.5°
C15	N24	H17	117.9°	120.0°
C20	N21	N16	106.5°	109.6°
N21	C20	C19	110.4°	108.7°
N21	C20	H9	124.8°	125.6°
N21	N16	C15	126.9°	132.1°
N21	N16	C17	111.0°	108.1°
C20	C19	C17	105.3°	106.9°
C20	C19	C22	127.7°	126.5°
C19	C20	H9	124.8°	125.6°
C15	N16	C17	122.1°	119.8°
N16	C15	C14	118.8°	119.1°
N16	C17	C19	106.8°	106.7°
N16	C17	N18	121.1°	120.9°
C15	C14	C13	117.2°	119.2°
C15	C14	H8	121.4°	120.4°
C17	C19	C22	127.0°	126.6°
C19	C17	N18	132.1°	132.4°
C19	C22	N23	179.3°	180.0°
C17	N18	C13	118.2°	120.9°
C14	C13	N18	122.5°	120.1°
C14	C13	N12	112.6°	120.0°
C13	C14	H8	121.4°	120.3°
N18	C13	N12	124.9°	119.9°
C13	N12	C5	127.0°	120.0°
C13	N12	H16	116.5°	120.0°
N12	C5	C6	123.4°	120.0°
N12	C5	C4	118.8°	120.1°
C5	N12	H16	116.5°	120.0°
C6	C5	C4	117.8°	119.9°
C5	C6	C7	121.7°	119.9°
C5	C6	H14	119.2°	120.1°
C5	C4	C3	120.9°	120.1°
C5	C4	H13	119.5°	119.9°
C6	C7	N8	117.1°	120.0°
C6	C7	C2	120.5°	119.9°
C7	C6	H14	119.2°	120.0°
C11	C9	O10	119.3°	120.0°
C11	C9	N8	118.6°	120.0°
C9	C11	H5	109.5°	109.5°
C9	C11	H6	109.4°	109.5°
C9	C11	H7	109.5°	109.5°
C4	C3	C2	121.1°	120.1°
C4	C3	H4	119.4°	119.9°
C3	C4	H13	119.5°	120.0°
O10	C9	N8	122.0°	120.0°
C9	N8	C7	127.6°	120.0°
C9	N8	H15	116.2°	120.0°
N8	C7	C2	122.4°	120.0°
C7	N8	H15	116.2°	120.0°
C7	C2	C3	118.0°	120.1°
C7	C2	C1	123.7°	120.0°
C3	C2	C1	118.3°	119.9°
C2	C3	H4	119.4°	120.0°
C2	C1	H1	109.5°	109.5°
C2	C1	H2	109.5°	109.4°
C2	C1	H3	109.5°	109.5°
H1	C1	H2	109.5°	109.5°
H1	C1	H3	109.4°	109.5°
H2	C1	H3	109.5°	109.4°
H5	C11	H6	109.5°	109.5°
H5	C11	H7	109.4°	109.4°
H6	C11	H7	109.5°	109.5°
H10	C30	H11	109.5°	109.5°
H10	C30	H12	109.5°	109.4°
H11	C30	H12	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N29	C28	N27	H19	180.0°	180.0°
C28	N29	C25	N24	180.0°	179.9°
C28	N29	C25	C26	0.4°	0.0°
N29	C28	N27	C30	179.9°	179.9°
N29	C28	N27	C26	0.4°	0.0°
C25	N29	C28	N27	0.0°	0.0°
N29	C25	N24	C26	179.5°	179.9°
N29	C25	C26	N27	0.7°	0.0°
N29	C25	N24	C15	123.7°	179.9°
N29	C25	N24	H17	56.3°	0.2°
N29	C25	C26	H18	179.4°	180.0°
C25	N29	C28	H19	180.0°	180.0°
C28	N27	C26	C25	0.6°	0.0°
C28	N27	C30	C26	179.6°	179.9°
C28	N27	C30	H10	180.0°	90.1°
C28	N27	C30	H11	60.0°	29.9°
C28	N27	C30	H12	60.0°	150.0°
C28	N27	C26	H18	179.4°	180.0°
N24	C25	C26	N27	179.8°	180.0°
C25	N24	C15	H17	180.0°	180.0°
C25	N24	C15	N16	169.9°	57.3°
C25	N24	C15	C14	11.1°	122.8°
N24	C25	C26	H18	0.2°	0.1°
C25	C26	N27	C30	179.7°	179.9°
C25	C26	N27	H18	180.0°	180.0°
C26	C25	N24	C15	56.8°	0.1°
C26	C25	N24	H17	123.2°	179.9°
N27	C30	H10	H11	120.0°	120.0°
N27	C30	H10	H12	120.0°	120.0°
N27	C30	H11	H12	120.0°	120.0°
C30	N27	C26	H18	0.3°	0.0°
C30	N27	C28	H19	0.1°	0.1°
C26	N27	C30	H10	0.4°	90.0°
C26	N27	C30	H11	120.3°	150.0°
C26	N27	C30	H12	119.7°	30.0°
C26	N27	C28	H19	179.6°	180.0°
N24	C15	N16	N21	1.2°	0.0°
N24	C15	N16	C14	179.1°	180.0°
N24	C15	N16	C17	179.5°	179.8°
N24	C15	C14	C13	179.6°	180.0°
N24	C15	C14	H8	0.4°	0.0°
N21	C20	C19	H9	180.0°	179.9°
C20	N21	N16	C15	179.8°	180.0°
C20	N21	N16	C17	0.8°	0.2°
N21	C20	C19	C17	0.6°	0.0°
N21	C20	C19	C22	178.8°	179.9°
N16	N21	C20	C19	0.1°	0.2°
N21	N16	C15	C17	179.3°	179.8°
N21	N16	C15	C14	179.8°	179.9°
N21	N16	C17	C19	1.1°	0.2°
N21	N16	C17	N18	179.3°	179.8°
N16	N21	C20	H9	179.9°	179.9°
C20	C19	C17	N16	1.0°	0.1°
C20	C19	C17	C22	178.2°	180.0°
C20	C19	C17	N18	179.6°	179.7°
C20	C19	C22	N23	39.0°	119.4°
C15	N16	C17	C19	179.4°	180.0°
C15	N16	C17	N18	0.1°	0.3°
N16	C15	C14	C13	0.6°	0.0°
N16	C15	C14	H8	179.4°	180.0°
N16	C15	N24	H17	10.0°	122.7°
C17	N16	C15	C14	0.4°	0.3°
N16	C17	C19	N18	179.4°	179.6°
N16	C17	C19	C22	179.2°	180.0°
N16	C17	N18	C13	0.3°	0.1°
C15	C14	C13	H8	180.0°	180.0°
C15	C14	C13	N18	0.4°	0.2°
C15	C14	C13	N12	179.7°	180.0°
C14	C15	N24	H17	168.9°	57.2°
C17	C19	C22	N23	138.8°	60.6°
C19	C17	N18	C13	179.0°	179.6°
C17	C19	C20	H9	179.4°	179.9°
C22	C19	C17	N18	1.3°	0.4°
C22	C19	C20	H9	1.2°	0.0°
C17	N18	C13	C14	0.1°	0.2°
C17	N18	C13	N12	179.1°	179.9°
C14	C13	N18	N12	179.2°	179.7°
C14	C13	N12	C5	179.1°	175.0°
C14	C13	N12	H16	0.9°	4.9°
N18	C13	N12	C5	1.6°	5.3°
N18	C13	C14	H8	179.6°	179.8°
N18	C13	N12	H16	178.4°	174.8°
C13	N12	C5	H16	180.0°	179.9°
C13	N12	C5	C6	17.3°	146.7°
C13	N12	C5	C4	164.6°	33.6°
N12	C13	C14	H8	0.3°	0.1°
N12	C5	C6	C4	178.1°	179.7°
N12	C5	C6	C7	179.7°	180.0°
N12	C5	C4	C3	178.7°	180.0°
N12	C5	C4	H13	1.4°	0.0°
N12	C5	C6	H14	0.3°	0.3°
C5	C6	C7	H14	180.0°	179.7°
C6	C5	C4	C3	0.4°	0.3°
C5	C6	C7	N8	178.5°	180.0°
C5	C6	C7	C2	2.8°	0.0°
C6	C5	C4	H13	179.6°	179.7°
C6	C5	N12	H16	162.7°	33.4°
C4	C5	C6	C7	2.2°	0.3°
C5	C4	C3	H13	180.0°	180.0°
C5	C4	C3	C2	0.7°	0.0°
C5	C4	C3	H4	179.3°	179.9°
C4	C5	C6	H14	177.9°	180.0°
C4	C5	N12	H16	15.4°	146.3°
C6	C7	N8	C9	68.0°	19.3°
C6	C7	N8	C2	178.7°	180.0°
C6	C7	C2	C3	1.5°	0.3°
C6	C7	C2	C1	179.7°	180.0°
C6	C7	N8	H15	112.0°	160.6°
C11	C9	O10	N8	178.1°	180.0°
C11	C9	N8	C7	8.1°	174.7°
C9	C11	H5	H6	120.0°	120.0°
C9	C11	H5	H7	120.0°	120.0°
C9	C11	H6	H7	120.0°	120.0°
C11	C9	N8	H15	171.9°	5.2°
C4	C3	C2	C7	0.2°	0.3°
C4	C3	C2	H4	180.0°	179.9°
C4	C3	C2	C1	178.6°	179.9°
O10	C9	N8	C7	173.8°	5.4°
O10	C9	C11	H5	0.0°	0.0°
O10	C9	C11	H6	120.0°	120.0°
O10	C9	C11	H7	120.0°	120.0°
O10	C9	N8	H15	6.2°	174.7°
C9	N8	C7	H15	180.0°	179.9°
C9	N8	C7	C2	113.3°	160.7°
N8	C9	C11	H5	178.2°	180.0°
N8	C9	C11	H6	58.2°	59.9°
N8	C9	C11	H7	61.8°	60.1°
N8	C7	C2	C3	179.8°	179.7°
N8	C7	C2	C1	1.0°	0.1°
N8	C7	C6	H14	1.5°	0.3°
C7	C2	C3	C1	178.8°	179.7°
C7	C2	C1	H1	89.3°	90.3°
C7	C2	C1	H2	150.7°	29.8°
C7	C2	C1	H3	30.7°	149.7°
C7	C2	C3	H4	179.8°	179.8°
C2	C7	C6	H14	177.2°	179.8°
C2	C7	N8	H15	66.7°	19.4°
C3	C2	C1	H1	89.5°	90.0°
C3	C2	C1	H2	30.6°	150.0°
C3	C2	C1	H3	150.6°	30.1°
C2	C3	C4	H13	179.2°	180.0°
C2	C1	H1	H2	120.0°	120.0°
C2	C1	H1	H3	120.0°	120.1°
C2	C1	H2	H3	120.0°	119.9°
C1	C2	C3	H4	1.4°	0.1°
H1	C1	H2	H3	120.0°	120.0°
H4	C3	C4	H13	0.8°	0.1°
H5	C11	H6	H7	120.0°	120.0°
H10	C30	H11	H12	120.0°	120.0°

Release date:	2013-09-25
Definition date:	2012-09-07
Last modified:	2013-09-20
Release status:	REL
Processing site:	RCSB
Derived from:	4GUB