EYB

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N2	C17	doub	1.30Å	1.34Å	Aromatic
N2	O1	sing	1.21Å	1.39Å	Aromatic
C17	C15	sing	1.42Å	1.41Å	Aromatic
O1	C16	sing	1.34Å	1.36Å	Aromatic
C15	C16	doub	1.37Å	1.38Å	Aromatic
C15	C3	sing	1.48Å	1.45Å
C2	C3	doub	1.40Å	1.40Å	Aromatic
C2	C1	sing	1.37Å	1.40Å	Aromatic
C3	C4	sing	1.39Å	1.40Å	Aromatic
C1	C6	doub	1.39Å	1.41Å	Aromatic
C4	C5	doub	1.39Å	1.40Å	Aromatic
C6	C5	sing	1.40Å	1.40Å	Aromatic
C6	C8	sing	1.47Å	1.43Å	Aromatic
C5	N1	sing	1.38Å	1.38Å	Aromatic
C8	C9	doub	1.39Å	1.41Å	Aromatic
C8	C7	sing	1.40Å	1.39Å	Aromatic
C9	C10	sing	1.38Å	1.41Å	Aromatic
N1	C7	sing	1.38Å	1.38Å	Aromatic
N1	C13	sing	1.46Å	1.45Å
C7	C12	doub	1.39Å	1.40Å	Aromatic
C13	C14	sing	1.53Å	1.52Å
C10	C18	sing	1.51Å	1.51Å
C10	C11	doub	1.39Å	1.41Å	Aromatic
C18	N3	sing	1.47Å	1.49Å
N3	C19	sing	1.47Å	1.49Å
C12	C11	sing	1.38Å	1.40Å	Aromatic
N3	H1	sing	1.01Å	1.00Å
N3	H2	sing	1.01Å	1.00Å
C4	H3	sing	1.08Å	1.08Å
C13	H4	sing	1.09Å	1.10Å
C13	H5	sing	1.09Å	1.10Å
C17	H6	sing	1.08Å	1.08Å
C1	H7	sing	1.08Å	1.08Å
C2	H8	sing	1.08Å	1.08Å
C9	H9	sing	1.08Å	1.08Å
C11	H10	sing	1.08Å	1.08Å
C12	H11	sing	1.08Å	1.08Å
C14	H12	sing	1.09Å	1.10Å
C14	H13	sing	1.09Å	1.10Å
C14	H14	sing	1.09Å	1.10Å
C16	H15	sing	1.08Å	1.08Å
C18	H16	sing	1.09Å	1.10Å
C18	H17	sing	1.09Å	1.10Å
C19	H18	sing	1.09Å	1.10Å
C19	H19	sing	1.09Å	1.10Å
C19	H20	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C17	N2	O1	105.4°	112.0°
N2	C17	C15	112.0°	106.3°
N2	C17	H6	124.0°	126.9°
N2	O1	C16	109.1°	111.9°
C17	C15	C16	103.8°	103.7°
C17	C15	C3	131.6°	128.2°
C15	C17	H6	124.0°	126.9°
O1	C16	C15	109.6°	106.2°
O1	C16	H15	125.2°	126.9°
C16	C15	C3	124.6°	128.1°
C15	C16	H15	125.2°	126.9°
C15	C3	C2	120.8°	119.9°
C15	C3	C4	119.5°	119.9°
C3	C2	C1	121.7°	120.3°
C2	C3	C4	119.7°	120.3°
C3	C2	H8	119.1°	119.8°
C2	C1	C6	119.0°	120.0°
C2	C1	H7	120.5°	120.0°
C1	C2	H8	119.2°	119.9°
C3	C4	C5	118.1°	119.9°
C3	C4	H3	120.9°	120.1°
C1	C6	C5	118.7°	120.3°
C1	C6	C8	133.7°	133.3°
C6	C1	H7	120.5°	120.0°
C4	C5	C6	122.7°	119.3°
C4	C5	N1	130.3°	132.3°
C5	C4	H3	120.9°	120.0°
C5	C6	C8	107.7°	106.4°
C6	C5	N1	107.0°	108.4°
C6	C8	C9	133.7°	133.4°
C6	C8	C7	107.4°	106.5°
C5	N1	C7	110.9°	110.3°
C5	N1	C13	124.4°	124.9°
C9	C8	C7	118.9°	120.1°
C8	C9	C10	120.1°	119.7°
C8	C9	H9	120.0°	120.1°
C8	C7	N1	107.1°	108.4°
C8	C7	C12	122.4°	119.3°
C9	C10	C18	120.2°	119.8°
C9	C10	C11	119.1°	120.3°
C10	C9	H9	120.0°	120.2°
C7	N1	C13	124.7°	124.9°
N1	C7	C12	130.6°	132.3°
N1	C13	C14	109.7°	109.5°
N1	C13	H4	109.4°	109.4°
N1	C13	H5	109.4°	109.5°
C7	C12	C11	117.8°	120.0°
C7	C12	H11	121.1°	120.0°
C14	C13	H4	109.4°	109.5°
C14	C13	H5	109.4°	109.5°
C13	C14	H12	109.5°	109.5°
C13	C14	H13	109.5°	109.5°
C13	C14	H14	109.5°	109.5°
C18	C10	C11	120.6°	119.9°
C10	C18	N3	113.8°	109.4°
C10	C18	H16	108.4°	109.5°
C10	C18	H17	108.4°	109.5°
C10	C11	C12	121.8°	120.6°
C10	C11	H10	119.1°	119.7°
C18	N3	C19	114.0°	109.4°
C18	N3	H1	108.3°	109.4°
C18	N3	H2	108.3°	109.5°
N3	C18	H16	108.4°	109.5°
N3	C18	H17	108.4°	109.5°
C19	N3	H1	108.4°	109.4°
C19	N3	H2	108.4°	109.5°
N3	C19	H18	109.5°	109.4°
N3	C19	H19	109.5°	109.5°
N3	C19	H20	109.5°	109.5°
C12	C11	H10	119.1°	119.7°
C11	C12	H11	121.1°	120.0°
H1	N3	H2	109.4°	109.5°
H4	C13	H5	109.5°	109.5°
H12	C14	H13	109.5°	109.4°
H12	C14	H14	109.5°	109.5°
H13	C14	H14	109.5°	109.4°
H16	C18	H17	109.5°	109.5°
H18	C19	H19	109.4°	109.5°
H18	C19	H20	109.5°	109.5°
H19	C19	H20	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N2	C17	C15	H6	180.0°	180.0°
C17	N2	O1	C16	0.3°	0.4°
N2	C17	C15	C16	0.4°	0.0°
N2	C17	C15	C3	179.1°	179.7°
O1	N2	C17	C15	0.1°	0.3°
N2	O1	C16	C15	0.6°	0.4°
O1	N2	C17	H6	180.0°	179.7°
N2	O1	C16	H15	179.4°	179.6°
C17	C15	C16	O1	0.6°	0.3°
C17	C15	C16	C3	178.8°	179.7°
C17	C15	C3	C2	7.6°	179.6°
C17	C15	C3	C4	173.6°	0.3°
C17	C15	C16	H15	179.4°	179.7°
O1	C16	C15	H15	180.0°	180.0°
O1	C16	C15	C3	179.4°	180.0°
C16	C15	C3	C2	170.9°	0.0°
C16	C15	C3	C4	7.9°	180.0°
C16	C15	C17	H6	179.6°	180.0°
C15	C3	C2	C4	178.8°	179.9°
C15	C3	C2	C1	179.4°	180.0°
C15	C3	C4	C5	179.5°	180.0°
C15	C3	C4	H3	0.6°	0.0°
C3	C15	C17	H6	0.9°	0.3°
C15	C3	C2	H8	0.7°	0.0°
C3	C15	C16	H15	0.5°	0.0°
C3	C2	C1	H8	180.0°	180.0°
C3	C2	C1	C6	0.1°	0.0°
C2	C3	C4	C5	0.6°	0.1°
C2	C3	C4	H3	179.4°	179.9°
C3	C2	C1	H7	179.9°	180.0°
C1	C2	C3	C4	0.5°	0.1°
C2	C1	C6	H7	180.0°	180.0°
C2	C1	C6	C5	0.2°	0.0°
C2	C1	C6	C8	179.9°	179.9°
C3	C4	C5	H3	180.0°	179.9°
C3	C4	C5	C6	0.3°	0.1°
C3	C4	C5	N1	179.0°	179.9°
C4	C3	C2	H8	179.5°	180.0°
C1	C6	C5	C4	0.1°	0.0°
C1	C6	C5	C8	179.9°	180.0°
C1	C6	C5	N1	179.6°	180.0°
C1	C6	C8	C9	0.3°	0.0°
C1	C6	C8	C7	179.9°	180.0°
C6	C1	C2	H8	179.9°	179.9°
C4	C5	C6	N1	179.4°	180.0°
C4	C5	C6	C8	179.9°	180.0°
C4	C5	N1	C7	179.8°	180.0°
C4	C5	N1	C13	1.9°	0.2°
C5	C6	C8	C9	179.6°	180.0°
C5	C6	C8	C7	0.0°	0.0°
C6	C5	N1	C7	0.8°	0.0°
C6	C5	N1	C13	178.7°	179.7°
C6	C5	C4	H3	179.7°	180.0°
C5	C6	C1	H7	179.8°	180.0°
C8	C6	C5	N1	0.5°	0.0°
C6	C8	C9	C7	179.6°	180.0°
C6	C8	C9	C10	179.9°	180.0°
C6	C8	C7	N1	0.5°	0.0°
C6	C8	C7	C12	179.9°	179.8°
C8	C6	C1	H7	0.1°	0.0°
C6	C8	C9	H9	0.1°	0.0°
C5	N1	C7	C8	0.8°	0.1°
C5	N1	C7	C13	177.9°	179.8°
C5	N1	C7	C12	179.6°	179.8°
C5	N1	C13	C14	92.5°	89.7°
N1	C5	C4	H3	1.0°	0.1°
C5	N1	C13	H4	147.5°	30.3°
C5	N1	C13	H5	27.5°	150.3°
C8	C9	C10	H9	180.0°	180.0°
C9	C8	C7	N1	179.8°	180.0°
C9	C8	C7	C12	0.2°	0.2°
C8	C9	C10	C18	179.5°	179.9°
C8	C9	C10	C11	0.6°	0.1°
C7	C8	C9	C10	0.3°	0.0°
C8	C7	N1	C12	179.6°	179.7°
C8	C7	N1	C13	178.7°	179.7°
C8	C7	C12	C11	0.3°	0.3°
C7	C8	C9	H9	179.7°	179.9°
C8	C7	C12	H11	179.7°	179.7°
C9	C10	C18	C11	178.9°	180.0°
C9	C10	C18	N3	84.0°	90.0°
C9	C10	C11	C12	0.7°	0.0°
C9	C10	C11	H10	179.3°	180.0°
C9	C10	C18	H16	155.3°	150.0°
C9	C10	C18	H17	36.6°	30.0°
C7	N1	C13	C14	85.1°	90.0°
N1	C7	C12	C11	179.9°	180.0°
C7	N1	C13	H4	34.9°	150.0°
C7	N1	C13	H5	154.9°	30.0°
N1	C7	C12	H11	0.1°	0.0°
C13	N1	C7	C12	1.7°	0.0°
N1	C13	C14	H4	120.0°	120.0°
N1	C13	C14	H5	120.0°	120.0°
N1	C13	H4	H5	119.9°	120.0°
N1	C13	C14	H12	180.0°	180.0°
N1	C13	C14	H13	60.0°	60.0°
N1	C13	C14	H14	60.0°	60.0°
C7	C12	C11	C10	0.6°	0.2°
C7	C12	C11	H11	180.0°	180.0°
C7	C12	C11	H10	179.4°	179.8°
C14	C13	H4	H5	119.9°	120.0°
C13	C14	H12	H13	120.0°	120.0°
C13	C14	H12	H14	120.0°	120.1°
C13	C14	H13	H14	120.0°	120.0°
C10	C18	N3	H16	120.6°	119.9°
C10	C18	N3	H17	120.6°	120.0°
C10	C18	N3	C19	171.9°	180.0°
C18	C10	C11	C12	179.6°	180.0°
C10	C18	N3	H1	67.4°	60.0°
C10	C18	N3	H2	51.2°	60.0°
C18	C10	C9	H9	0.5°	0.0°
C18	C10	C11	H10	0.4°	0.0°
C10	C18	H16	H17	118.0°	120.0°
C11	C10	C18	N3	97.1°	90.0°
C10	C11	C12	H10	180.0°	180.0°
C11	C10	C9	H9	179.4°	179.9°
C10	C11	C12	H11	179.4°	179.8°
C11	C10	C18	H16	23.5°	30.0°
C11	C10	C18	H17	142.3°	150.0°
C18	N3	C19	H1	120.7°	119.9°
C18	N3	C19	H2	120.7°	120.0°
C18	N3	H1	H2	117.9°	120.0°
N3	C18	H16	H17	118.1°	120.1°
C18	N3	C19	H18	180.0°	60.0°
C18	N3	C19	H19	60.0°	60.0°
C18	N3	C19	H20	60.0°	180.0°
C19	N3	H1	H2	118.0°	120.1°
C19	N3	C18	H16	51.3°	60.0°
C19	N3	C18	H17	67.5°	60.1°
N3	C19	H18	H19	120.0°	120.0°
N3	C19	H18	H20	120.0°	120.0°
N3	C19	H19	H20	120.0°	120.0°
H1	N3	C18	H16	172.0°	59.9°
H1	N3	C18	H17	53.2°	180.0°
H1	N3	C19	H18	59.3°	180.0°
H1	N3	C19	H19	179.3°	60.0°
H1	N3	C19	H20	60.7°	60.1°
H2	N3	C18	H16	69.4°	180.0°
H2	N3	C18	H17	171.8°	59.9°
H2	N3	C19	H18	59.3°	60.0°
H2	N3	C19	H19	60.7°	180.0°
H2	N3	C19	H20	179.3°	60.0°
H4	C13	C14	H12	60.0°	60.0°
H4	C13	C14	H13	180.0°	180.0°
H4	C13	C14	H14	60.0°	60.0°
H5	C13	C14	H12	60.0°	60.0°
H5	C13	C14	H13	60.0°	60.0°
H5	C13	C14	H14	180.0°	180.0°
H7	C1	C2	H8	0.1°	0.0°
H10	C11	C12	H11	0.6°	0.2°
H12	C14	H13	H14	120.0°	120.0°
H18	C19	H19	H20	120.0°	120.0°

Release date:	2019-05-22
Definition date:	2018-05-04
Last modified:	2019-05-17
Release status:	REL
Processing site:	RCSB
Derived from:	6GGD