8KO

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C14	C13	sing	1.53Å	1.50Å
C13	C15	sing	1.53Å	1.51Å
C13	C12	sing	1.53Å	1.49Å
C12	C11	sing	1.53Å	1.52Å
O	C	sing	1.43Å	1.28Å
O2	C10	doub	1.21Å	1.22Å
C10	N2	sing	1.35Å	1.35Å
C10	C	sing	1.51Å	1.47Å
C11	N2	sing	1.46Å	1.47Å
C11	C16	sing	1.51Å	1.54Å
C	CA	sing	1.53Å	1.55Å
C16	N3	sing	1.35Å	1.37Å
C16	O3	doub	1.21Å	1.22Å
N	CA	sing	1.47Å	1.48Å
N3	O4	sing	1.42Å	1.43Å
CA	CB	sing	1.53Å	1.53Å
CB	CG	sing	1.51Å	1.51Å
CG	CD1	doub	1.38Å	1.39Å	Aromatic
CG	CD2	sing	1.38Å	1.38Å	Aromatic
CD1	CE1	sing	1.38Å	1.39Å	Aromatic
CD2	CE2	doub	1.38Å	1.41Å	Aromatic
CE1	CZ	doub	1.38Å	1.39Å	Aromatic
CE2	CZ	sing	1.38Å	1.37Å	Aromatic
N	H1	sing	1.01Å	1.00Å
N	H2	sing	1.01Å	1.00Å
CA	H4	sing	1.09Å	1.10Å
CB	H5	sing	1.09Å	1.10Å
CB	H6	sing	1.09Å	1.10Å
CD2	H7	sing	1.08Å	1.08Å
CE2	H8	sing	1.08Å	1.08Å
CZ	H9	sing	1.08Å	1.08Å
CE1	H10	sing	1.08Å	1.08Å
CD1	H11	sing	1.08Å	1.08Å
C	H12	sing	1.09Å	1.10Å
O	H13	sing	0.97Å	0.95Å
N2	H14	sing	0.97Å	1.00Å
C11	H15	sing	1.09Å	1.10Å
C12	H16	sing	1.09Å	1.10Å
C14	H17	sing	1.09Å	1.10Å
C14	H18	sing	1.09Å	1.10Å
C14	H19	sing	1.09Å	1.10Å
C15	H20	sing	1.09Å	1.10Å
C15	H21	sing	1.09Å	1.10Å
C15	H22	sing	1.09Å	1.10Å
N3	H23	sing	0.97Å	1.00Å
O4	H24	sing	0.97Å	0.95Å
C12	H3	sing	1.09Å	1.10Å
C13	H25	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C14	C13	C15	119.6°	109.5°
C14	C13	C12	115.2°	109.4°
C13	C14	H17	109.5°	109.4°
C13	C14	H18	109.5°	109.5°
C13	C14	H19	109.5°	109.4°
C14	C13	H25	96.9°	109.5°
C15	C13	C12	120.9°	109.5°
C13	C15	H20	109.5°	109.5°
C13	C15	H21	109.4°	109.5°
C13	C15	H22	109.5°	109.5°
C15	C13	H25	96.9°	109.5°
C13	C12	C11	118.7°	109.5°
C13	C12	H16	107.1°	109.5°
C13	C12	H3	107.1°	109.4°
C12	C13	H25	97.0°	109.4°
C12	C11	N2	108.0°	109.5°
C12	C11	C16	106.1°	109.5°
C12	C11	H15	113.1°	109.5°
C11	C12	H16	107.1°	109.5°
C11	C12	H3	107.1°	109.5°
O	C	C10	100.1°	109.5°
O	C	CA	121.3°	109.5°
O	C	H12	112.3°	109.5°
C	O	H13	109.5°	114.0°
O2	C10	N2	126.1°	120.0°
O2	C10	C	117.1°	120.0°
N2	C10	C	116.7°	120.0°
C10	N2	C11	124.8°	120.0°
C10	N2	H14	117.6°	120.0°
C10	C	CA	104.4°	109.5°
C10	C	H12	109.3°	109.4°
N2	C11	C16	102.3°	109.4°
C11	N2	H14	117.6°	120.0°
N2	C11	H15	113.8°	109.5°
C11	C16	N3	117.4°	120.0°
C11	C16	O3	119.4°	120.0°
C16	C11	H15	112.8°	109.5°
C	CA	N	103.3°	109.4°
C	CA	CB	111.6°	109.5°
C	CA	H4	109.9°	109.5°
CA	C	H12	108.3°	109.4°
N3	C16	O3	123.1°	120.0°
C16	N3	O4	120.1°	120.0°
C16	N3	H23	120.0°	120.0°
N	CA	CB	110.6°	109.5°
CA	N	H1	109.5°	110.9°
CA	N	H2	109.5°	111.0°
N	CA	H4	111.0°	109.5°
O4	N3	H23	119.9°	120.0°
N3	O4	H24	109.5°	114.0°
CA	CB	CG	115.2°	109.5°
CB	CA	H4	110.3°	109.5°
CA	CB	H5	108.0°	109.5°
CA	CB	H6	108.0°	109.5°
CB	CG	CD1	120.9°	120.0°
CB	CG	CD2	120.9°	120.0°
CG	CB	H5	108.0°	109.5°
CG	CB	H6	108.0°	109.5°
CD1	CG	CD2	118.1°	120.0°
CG	CD1	CE1	122.3°	120.0°
CG	CD1	H11	118.9°	120.0°
CG	CD2	CE2	119.8°	120.0°
CG	CD2	H7	120.1°	120.0°
CD1	CE1	CZ	119.0°	120.0°
CD1	CE1	H10	120.5°	120.0°
CE1	CD1	H11	118.8°	120.0°
CD2	CE2	CZ	121.3°	120.0°
CE2	CD2	H7	120.1°	120.0°
CD2	CE2	H8	119.3°	120.0°
CE1	CZ	CE2	119.4°	120.0°
CE1	CZ	H9	120.3°	120.0°
CZ	CE1	H10	120.5°	120.0°
CZ	CE2	H8	119.3°	120.0°
CE2	CZ	H9	120.3°	120.0°
H1	N	H2	109.4°	111.0°
H5	CB	H6	109.5°	109.4°
H16	C12	H3	109.5°	109.4°
H17	C14	H18	109.4°	109.5°
H17	C14	H19	109.4°	109.5°
H18	C14	H19	109.5°	109.5°
H20	C15	H21	109.5°	109.4°
H20	C15	H22	109.5°	109.5°
H21	C15	H22	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C14	C13	C15	C12	155.6°	120.0°
C14	C13	C15	H25	102.0°	120.0°
C14	C13	C12	H25	101.1°	119.9°
C14	C13	C12	C11	165.1°	175.0°
C14	C13	C12	H16	73.6°	54.9°
C13	C14	H17	H18	120.0°	120.1°
C13	C14	H17	H19	120.0°	119.9°
C13	C14	H18	H19	120.0°	120.0°
C14	C13	C15	H20	180.0°	60.0°
C14	C13	C15	H21	60.0°	60.0°
C14	C13	C15	H22	60.0°	180.0°
C14	C13	C12	H3	43.8°	65.0°
C15	C13	C12	H25	102.3°	120.0°
C15	C13	C12	C11	8.5°	65.0°
C15	C13	C12	H16	129.8°	175.0°
C15	C13	C14	H17	180.0°	60.0°
C15	C13	C14	H18	60.0°	180.0°
C15	C13	C14	H19	60.0°	60.0°
C13	C15	H20	H21	120.0°	120.0°
C13	C15	H20	H22	120.0°	120.0°
C13	C15	H21	H22	120.0°	120.0°
C15	C13	C12	H3	112.8°	55.1°
C13	C12	C11	H16	121.3°	120.1°
C13	C12	C11	H3	121.3°	120.0°
C13	C12	C11	N2	125.6°	65.0°
C13	C12	C11	C16	125.4°	175.0°
C13	C12	C11	H15	1.3°	55.0°
C13	C12	H16	H3	115.8°	119.9°
C12	C13	C14	H17	23.1°	180.0°
C12	C13	C14	H18	143.1°	60.0°
C12	C13	C14	H19	96.9°	60.1°
C12	C13	C15	H20	24.4°	180.0°
C12	C13	C15	H21	95.6°	60.0°
C12	C13	C15	H22	144.4°	60.0°
C12	C11	N2	C10	104.3°	155.0°
C12	C11	N2	C16	111.7°	120.0°
C12	C11	N2	H15	126.4°	120.0°
C12	C11	C16	H15	124.3°	120.1°
C12	C11	C16	N3	75.4°	60.1°
C12	C11	C16	O3	101.8°	120.0°
C12	C11	N2	H14	75.7°	25.0°
C11	C12	H16	H3	115.8°	120.0°
C11	C12	C13	H25	93.9°	55.1°
O	C	C10	O2	49.6°	5.1°
O	C	C10	N2	126.5°	174.9°
O	C	C10	CA	126.3°	120.1°
O	C	C10	H12	118.1°	120.0°
O	C	CA	H12	132.0°	120.0°
O	C	CA	N	30.0°	65.0°
O	C	CA	CB	148.8°	55.0°
O	C	CA	H4	88.5°	175.0°
O2	C10	N2	C	175.7°	180.0°
O2	C10	N2	C11	3.8°	0.0°
O2	C10	C	CA	76.6°	115.0°
O2	C10	C	H12	167.7°	125.0°
O2	C10	N2	H14	176.2°	180.0°
C10	N2	C11	H14	180.0°	180.0°
C10	N2	C11	C16	144.1°	85.0°
N2	C10	C	CA	107.3°	65.0°
N2	C10	C	H12	8.4°	55.0°
C10	N2	C11	H15	22.1°	35.0°
C	C10	N2	C11	179.5°	180.0°
C10	C	CA	H12	116.4°	119.9°
C10	C	CA	N	141.6°	55.0°
C10	C	CA	CB	99.6°	175.0°
C10	C	CA	H4	23.1°	65.0°
C10	C	O	H13	21.3°	60.1°
C	C10	N2	H14	0.5°	0.0°
N2	C11	C16	H15	122.7°	120.0°
N2	C11	C16	N3	171.6°	180.0°
N2	C11	C16	O3	11.3°	0.0°
N2	C11	C12	H16	113.1°	55.0°
N2	C11	C12	H3	4.3°	175.0°
C11	C16	N3	O3	177.0°	180.0°
C11	C16	N3	O4	176.8°	180.0°
C16	C11	N2	H14	35.9°	95.0°
C16	C11	C12	H16	4.1°	64.9°
C11	C16	N3	H23	3.3°	0.1°
C16	C11	C12	H3	113.3°	55.1°
C	CA	N	CB	119.6°	120.0°
C	CA	N	H4	117.7°	120.0°
C	CA	CB	H4	122.5°	120.0°
C	CA	CB	CG	156.4°	175.0°
C	CA	N	H1	180.0°	176.1°
C	CA	N	H2	60.0°	60.0°
C	CA	CB	H5	35.6°	55.0°
C	CA	CB	H6	82.8°	65.0°
CA	C	O	H13	92.6°	60.0°
C16	N3	O4	H23	180.0°	179.9°
N3	C16	C11	H15	48.9°	60.0°
C16	N3	O4	H24	0.1°	180.0°
O3	C16	N3	O4	0.2°	0.0°
O3	C16	C11	H15	134.0°	120.0°
O3	C16	N3	H23	179.7°	180.0°
N	CA	CB	H4	123.1°	120.0°
N	CA	CB	CG	89.2°	65.0°
CA	N	H1	H2	120.0°	123.9°
N	CA	CB	H5	150.0°	174.9°
N	CA	CB	H6	31.7°	55.0°
N	CA	C	H12	102.0°	175.0°
CA	CB	CG	H5	120.8°	120.0°
CA	CB	CG	H6	120.8°	120.0°
CA	CB	CG	CD1	78.1°	90.0°
CA	CB	CG	CD2	103.9°	89.7°
CB	CA	N	H1	60.4°	63.9°
CB	CA	N	H2	59.5°	60.0°
CA	CB	H5	H6	117.4°	120.0°
CB	CA	C	H12	16.8°	65.0°
CB	CG	CD1	CD2	178.0°	179.7°
CB	CG	CD1	CE1	179.7°	179.8°
CB	CG	CD2	CE2	176.6°	179.9°
CG	CB	CA	H4	33.9°	55.0°
CG	CB	H5	H6	117.4°	120.0°
CB	CG	CD2	H7	3.4°	0.0°
CB	CG	CD1	H11	0.3°	0.0°
CG	CD1	CE1	H11	180.0°	179.7°
CD1	CG	CD2	CE2	1.4°	0.3°
CG	CD1	CE1	CZ	2.7°	0.5°
CD1	CG	CB	H5	42.7°	30.1°
CD1	CG	CB	H6	161.1°	150.0°
CD1	CG	CD2	H7	178.6°	179.7°
CG	CD1	CE1	H10	177.3°	179.8°
CD2	CG	CD1	CE1	1.7°	0.5°
CG	CD2	CE2	H7	180.0°	180.0°
CG	CD2	CE2	CZ	3.5°	0.0°
CD2	CG	CB	H5	135.3°	150.3°
CD2	CG	CB	H6	16.9°	30.3°
CG	CD2	CE2	H8	176.5°	179.9°
CD2	CG	CD1	H11	178.3°	179.7°
CD1	CE1	CZ	H10	180.0°	179.7°
CD1	CE1	CZ	CE2	0.6°	0.3°
CD1	CE1	CZ	H9	179.4°	179.8°
CD2	CE2	CZ	CE1	2.5°	0.0°
CD2	CE2	CZ	H8	180.0°	179.9°
CD2	CE2	CZ	H9	177.5°	179.9°
CE1	CZ	CE2	H9	180.0°	179.9°
CE1	CZ	CE2	H8	177.5°	179.9°
CZ	CE1	CD1	H11	177.3°	179.7°
CZ	CE2	CD2	H7	176.4°	180.0°
CE2	CZ	CE1	H10	179.4°	180.0°
H1	N	CA	H4	62.3°	56.1°
H2	N	CA	H4	177.8°	180.0°
H4	CA	CB	H5	86.9°	65.0°
H4	CA	CB	H6	154.7°	175.0°
H4	CA	C	H12	139.5°	55.0°
H7	CD2	CE2	H8	3.6°	0.1°
H8	CE2	CZ	H9	2.5°	0.0°
H9	CZ	CE1	H10	0.6°	0.1°
H10	CE1	CD1	H11	2.7°	0.0°
H12	C	O	H13	137.1°	180.0°
H14	N2	C11	H15	157.9°	145.0°
H15	C11	C12	H16	120.0°	175.0°
H15	C11	C12	H3	122.6°	65.0°
H16	C12	C13	H25	27.5°	65.0°
H17	C14	H18	H19	120.0°	120.0°
H17	C14	C13	H25	78.0°	60.1°
H18	C14	C13	H25	42.0°	59.9°
H19	C14	C13	H25	162.0°	180.0°
H20	C15	H21	H22	120.0°	120.0°
H20	C15	C13	H25	78.0°	60.0°
H21	C15	C13	H25	162.0°	180.0°
H22	C15	C13	H25	42.0°	60.0°
H23	N3	O4	H24	179.9°	0.1°
H3	C12	C13	H25	144.8°	175.1°

Release date:	2018-08-01
Definition date:	2017-07-26
Last modified:	2018-07-27
Release status:	REL
Processing site:	PDBJ
Derived from:	5Y19