35W

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C27	C28	doub	1.38Å	1.38Å	Aromatic
C27	N26	sing	1.32Å	1.32Å	Aromatic
C28	C23	sing	1.40Å	1.40Å	Aromatic
C21	N22	doub	1.32Å	1.32Å	Aromatic
C21	C20	sing	1.40Å	1.40Å	Aromatic
N22	C17	sing	1.33Å	1.33Å	Aromatic
N26	C25	doub	1.32Å	1.32Å	Aromatic
C23	C20	sing	1.48Å	1.48Å
C23	C24	doub	1.40Å	1.40Å	Aromatic
C20	N19	doub	1.33Å	1.33Å	Aromatic
C17	N15	sing	1.37Å	1.37Å	Aromatic
C17	C18	doub	1.41Å	1.41Å	Aromatic
C25	C24	sing	1.38Å	1.38Å	Aromatic
N15	C14	sing	1.37Å	1.37Å	Aromatic
N19	C18	sing	1.33Å	1.33Å	Aromatic
C18	C13	sing	1.47Å	1.47Å	Aromatic
C14	C13	doub	1.35Å	1.35Å	Aromatic
C13	C10	sing	1.49Å	1.49Å
C10	C11	sing	1.41Å	1.41Å	Aromatic
C10	C9	doub	1.36Å	1.36Å	Aromatic
C11	N12	doub	1.31Å	1.31Å	Aromatic
C9	N8	sing	1.35Å	1.35Å	Aromatic
N12	N8	sing	1.40Å	1.40Å	Aromatic
N8	C7	sing	1.47Å	1.46Å
C7	C4	sing	1.51Å	1.50Å
C5	C4	doub	1.38Å	1.38Å	Aromatic
C5	C6	sing	1.38Å	1.38Å	Aromatic
C4	C3	sing	1.38Å	1.38Å	Aromatic
C6	C1	doub	1.38Å	1.38Å	Aromatic
C3	C2	doub	1.38Å	1.38Å	Aromatic
C1	C2	sing	1.38Å	1.38Å	Aromatic
C5	H1	sing	1.08Å	1.08Å
C6	H2	sing	1.08Å	1.08Å
C7	H3	sing	1.09Å	1.10Å
C7	H4	sing	1.09Å	1.10Å
C21	H5	sing	1.08Å	1.08Å
C24	H6	sing	1.08Å	1.08Å
C28	H7	sing	1.08Å	1.08Å
C1	H8	sing	1.08Å	1.08Å
C2	H9	sing	1.08Å	1.08Å
C3	H10	sing	1.08Å	1.08Å
C9	H11	sing	1.08Å	1.08Å
C11	H12	sing	1.08Å	1.08Å
C14	H13	sing	1.08Å	1.08Å
N15	H14	sing	0.97Å	1.00Å
C25	H15	sing	1.08Å	1.08Å
C27	H16	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C28	C27	N26	120.9°	120.9°
C27	C28	C23	118.7°	119.0°
C27	C28	H7	120.6°	120.5°
C28	C27	H16	119.5°	119.5°
C27	N26	C25	122.2°	122.0°
N26	C27	H16	119.5°	119.6°
C28	C23	C20	120.8°	120.9°
C28	C23	C24	118.4°	118.1°
C23	C28	H7	120.6°	120.4°
N22	C21	C20	120.4°	120.5°
C21	N22	C17	120.0°	120.1°
N22	C21	H5	119.8°	119.8°
C21	C20	C23	120.0°	120.0°
C21	C20	N19	120.3°	120.1°
C20	C21	H5	119.8°	119.8°
N22	C17	N15	133.1°	133.1°
N22	C17	C18	119.6°	119.6°
N26	C25	C24	120.7°	120.9°
N26	C25	H15	119.7°	119.6°
C20	C23	C24	120.8°	121.0°
C23	C20	N19	119.7°	119.9°
C23	C24	C25	119.0°	119.1°
C23	C24	H6	120.5°	120.4°
C20	N19	C18	119.6°	119.7°
N15	C17	C18	107.3°	107.3°
C17	N15	C14	110.1°	110.2°
C17	N15	H14	125.0°	124.9°
C17	C18	N19	120.0°	120.2°
C17	C18	C13	106.1°	106.0°
C25	C24	H6	120.5°	120.5°
C24	C25	H15	119.7°	119.5°
N15	C14	C13	110.1°	109.8°
N15	C14	H13	125.0°	125.1°
C14	N15	H14	125.0°	124.9°
N19	C18	C13	133.8°	133.9°
C18	C13	C14	106.5°	106.7°
C18	C13	C10	126.9°	126.7°
C14	C13	C10	126.7°	126.6°
C13	C14	H13	125.0°	125.1°
C13	C10	C11	125.9°	126.2°
C13	C10	C9	126.5°	126.2°
C11	C10	C9	107.6°	107.6°
C10	C11	N12	108.2°	108.1°
C10	C11	H12	125.9°	126.0°
C10	C9	N8	107.4°	107.6°
C10	C9	H11	126.3°	126.2°
C11	N12	N8	108.5°	108.5°
N12	C11	H12	125.9°	125.9°
C9	N8	N12	108.3°	108.2°
C9	N8	C7	126.0°	125.9°
N8	C9	H11	126.3°	126.2°
N12	N8	C7	125.7°	125.9°
N8	C7	C4	107.3°	109.5°
N8	C7	H3	110.0°	109.5°
N8	C7	H4	110.0°	109.4°
C7	C4	C5	119.9°	120.0°
C7	C4	C3	119.9°	120.0°
C4	C7	H3	110.0°	109.5°
C4	C7	H4	110.0°	109.5°
C4	C5	C6	119.8°	120.0°
C5	C4	C3	120.2°	120.0°
C4	C5	H1	120.1°	120.0°
C5	C6	C1	120.0°	120.0°
C6	C5	H1	120.1°	120.0°
C5	C6	H2	120.0°	120.0°
C4	C3	C2	120.0°	120.0°
C4	C3	H10	120.0°	120.0°
C6	C1	C2	120.2°	120.0°
C1	C6	H2	120.0°	120.0°
C6	C1	H8	119.9°	120.0°
C3	C2	C1	119.9°	120.0°
C3	C2	H9	120.1°	120.0°
C2	C3	H10	120.0°	120.0°
C2	C1	H8	119.9°	120.0°
C1	C2	H9	120.1°	120.0°
H3	C7	H4	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C28	C27	N26	H16	180.0°	179.8°
C27	C28	C23	H7	180.0°	179.9°
C28	C27	N26	C25	0.1°	0.2°
C27	C28	C23	C20	179.9°	180.0°
C27	C28	C23	C24	0.0°	0.1°
N26	C27	C28	C23	0.1°	0.2°
C27	N26	C25	C24	0.0°	0.0°
N26	C27	C28	H7	179.9°	179.7°
C27	N26	C25	H15	180.0°	179.9°
C28	C23	C20	C21	0.8°	5.0°
C28	C23	C20	C24	179.9°	179.9°
C28	C23	C20	N19	179.2°	175.0°
C28	C23	C24	C25	0.1°	0.3°
C28	C23	C24	H6	179.9°	180.0°
C23	C28	C27	H16	179.9°	180.0°
N22	C21	C20	H5	180.0°	179.5°
N22	C21	C20	C23	180.0°	179.7°
N22	C21	C20	N19	0.0°	0.3°
C21	N22	C17	N15	180.0°	179.8°
C21	N22	C17	C18	0.0°	0.5°
C20	C21	N22	C17	0.0°	0.5°
C21	C20	C23	N19	180.0°	180.0°
C21	C20	C23	C24	179.2°	174.9°
C21	C20	N19	C18	0.0°	0.0°
N22	C17	N15	C18	180.0°	179.7°
N22	C17	N15	C14	179.9°	180.0°
N22	C17	C18	N19	0.1°	0.2°
N22	C17	C18	C13	179.9°	179.8°
C17	N22	C21	H5	180.0°	180.0°
N22	C17	N15	H14	0.1°	0.4°
N26	C25	C24	C23	0.1°	0.3°
N26	C25	C24	H15	180.0°	179.9°
N26	C25	C24	H6	179.9°	179.9°
C25	N26	C27	H16	179.9°	180.0°
C20	C23	C24	C25	180.0°	179.8°
C23	C20	N19	C18	180.0°	180.0°
C23	C20	C21	H5	0.0°	0.3°
C20	C23	C24	H6	0.0°	0.1°
C20	C23	C28	H7	0.1°	0.1°
C24	C23	C20	N19	0.8°	5.1°
C23	C24	C25	H6	180.0°	179.7°
C24	C23	C28	H7	180.0°	180.0°
C23	C24	C25	H15	180.0°	179.7°
C20	N19	C18	C17	0.1°	0.0°
C20	N19	C18	C13	179.8°	179.4°
N19	C20	C21	H5	180.0°	179.7°
C17	N15	C14	H14	180.0°	179.6°
N15	C17	C18	N19	179.9°	180.0°
N15	C17	C18	C13	0.2°	0.5°
C17	N15	C14	C13	0.3°	0.0°
C17	N15	C14	H13	179.7°	180.0°
C18	C17	N15	C14	0.0°	0.3°
C17	C18	N19	C13	179.7°	179.4°
C17	C18	C13	C14	0.3°	0.5°
C17	C18	C13	C10	179.5°	179.9°
C18	C17	N15	H14	179.9°	180.0°
N15	C14	C13	C18	0.3°	0.3°
N15	C14	C13	H13	180.0°	180.0°
N15	C14	C13	C10	179.5°	180.0°
N19	C18	C13	C14	179.9°	179.9°
N19	C18	C13	C10	0.8°	0.4°
C18	C13	C14	C10	179.2°	179.7°
C18	C13	C10	C11	157.8°	50.4°
C18	C13	C10	C9	22.2°	130.0°
C18	C13	C14	H13	179.7°	179.8°
C14	C13	C10	C11	21.2°	130.0°
C14	C13	C10	C9	158.8°	49.7°
C13	C14	N15	H14	179.7°	179.7°
C13	C10	C11	C9	180.0°	179.7°
C13	C10	C11	N12	179.8°	179.8°
C13	C10	C9	N8	179.7°	179.8°
C13	C10	C9	H11	0.3°	0.3°
C13	C10	C11	H12	0.2°	0.3°
C10	C13	C14	H13	0.5°	0.1°
C10	C11	N12	H12	180.0°	180.0°
C11	C10	C9	N8	0.3°	0.1°
C10	C11	N12	N8	0.0°	0.0°
C11	C10	C9	H11	179.7°	179.9°
C9	C10	C11	N12	0.2°	0.0°
C10	C9	N8	H11	180.0°	179.9°
C10	C9	N8	N12	0.4°	0.1°
C10	C9	N8	C7	179.8°	179.9°
C9	C10	C11	H12	179.8°	180.0°
C11	N12	N8	C9	0.2°	0.1°
C11	N12	N8	C7	179.7°	179.9°
C9	N8	N12	C7	179.4°	179.9°
C9	N8	C7	C4	76.7°	124.9°
C9	N8	C7	H3	43.0°	4.9°
C9	N8	C7	H4	163.7°	115.0°
N12	N8	C7	C4	102.7°	54.9°
N12	N8	C7	H3	137.7°	174.9°
N12	N8	C7	H4	17.0°	65.1°
N12	N8	C9	H11	179.7°	180.0°
N8	N12	C11	H12	179.9°	180.0°
N8	C7	C4	H3	119.7°	120.0°
N8	C7	C4	H4	119.6°	119.9°
N8	C7	C4	C5	91.4°	90.3°
N8	C7	C4	C3	87.8°	89.9°
N8	C7	H3	H4	121.0°	119.9°
C7	N8	C9	H11	0.3°	0.2°
C7	C4	C5	C3	179.2°	179.8°
C7	C4	C5	C6	179.6°	179.7°
C7	C4	C3	C2	179.7°	179.8°
C7	C4	C5	H1	0.4°	0.2°
C4	C7	H3	H4	121.0°	120.1°
C7	C4	C3	H10	0.4°	0.3°
C4	C5	C6	H1	180.0°	180.0°
C4	C5	C6	C1	0.2°	0.0°
C5	C4	C3	C2	0.4°	0.0°
C4	C5	C6	H2	179.7°	179.9°
C5	C4	C7	H3	28.3°	29.7°
C5	C4	C7	H4	148.9°	149.8°
C5	C4	C3	H10	179.6°	180.0°
C6	C5	C4	C3	0.4°	0.0°
C5	C6	C1	H2	180.0°	179.9°
C5	C6	C1	C2	0.2°	0.1°
C5	C6	C1	H8	179.9°	179.9°
C4	C3	C2	H10	180.0°	180.0°
C4	C3	C2	C1	0.3°	0.1°
C3	C4	C5	H1	179.6°	180.0°
C3	C4	C7	H3	152.5°	150.0°
C3	C4	C7	H4	31.8°	30.0°
C4	C3	C2	H9	179.7°	180.0°
C6	C1	C2	C3	0.2°	0.1°
C6	C1	C2	H8	180.0°	180.0°
C1	C6	C5	H1	179.8°	180.0°
C6	C1	C2	H9	179.8°	180.0°
C3	C2	C1	H9	180.0°	179.9°
C3	C2	C1	H8	179.8°	179.9°
C2	C1	C6	H2	179.8°	180.0°
C1	C2	C3	H10	179.7°	180.0°
H1	C5	C6	H2	0.2°	0.1°
H2	C6	C1	H8	0.1°	0.0°
H6	C24	C25	H15	0.1°	0.0°
H7	C28	C27	H16	0.1°	0.1°
H8	C1	C2	H9	0.2°	0.0°
H9	C2	C3	H10	0.3°	0.1°
H13	C14	N15	H14	0.3°	0.3°

Release date:	2015-09-23
Definition date:	2014-06-25
Last modified:	2015-09-18
Release status:	REL
Processing site:	RCSB
Derived from:	4QPA