U4C

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C9	C10	sing	1.55Å	1.52Å
C9	N1	sing	1.48Å	1.47Å
C10	C11	sing	1.55Å	1.52Å
N1	C8	sing	1.47Å	1.47Å
C11	C8	sing	1.54Å	1.54Å
O	C	doub	1.21Å	1.22Å
C8	C	sing	1.50Å	1.52Å
C8	C7	sing	1.53Å	1.54Å
C	N	sing	1.35Å	1.35Å
C7	C2	sing	1.51Å	1.50Å
N	C1	sing	1.40Å	1.39Å
C2	C1	doub	1.39Å	1.40Å	Aromatic
C2	C3	sing	1.38Å	1.39Å	Aromatic
C1	C6	sing	1.39Å	1.39Å	Aromatic
C3	C4	doub	1.38Å	1.38Å	Aromatic
C6	C5	doub	1.38Å	1.39Å	Aromatic
C4	C5	sing	1.38Å	1.38Å	Aromatic
N1	H1	sing	1.01Å	1.00Å
C4	H3	sing	1.08Å	1.08Å
C5	H4	sing	1.08Å	1.08Å
C6	H5	sing	1.08Å	1.08Å
C7	H6	sing	1.09Å	1.10Å
C7	H7	sing	1.09Å	1.10Å
C10	H8	sing	1.09Å	1.10Å
C10	H9	sing	1.09Å	1.10Å
C11	H10	sing	1.09Å	1.10Å
C11	H11	sing	1.09Å	1.10Å
C9	H12	sing	1.09Å	1.10Å
C9	H13	sing	1.09Å	1.10Å
C3	H14	sing	1.08Å	1.08Å
N	H15	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C10	C9	N1	105.3°	104.8°
C9	C10	C11	103.9°	101.7°
C9	C10	H8	110.9°	111.1°
C9	C10	H9	110.9°	111.0°
C10	C9	H12	110.5°	110.4°
C10	C9	H13	110.5°	110.3°
C9	N1	C8	110.9°	108.4°
C9	N1	H1	109.1°	111.0°
N1	C9	H12	110.5°	110.4°
N1	C9	H13	110.5°	110.4°
C10	C11	C8	105.1°	103.0°
C11	C10	H8	110.9°	110.9°
C11	C10	H9	110.9°	111.0°
C10	C11	H10	110.5°	110.7°
C10	C11	H11	110.6°	110.7°
N1	C8	C11	104.6°	107.5°
N1	C8	C	107.1°	109.9°
N1	C8	C7	107.2°	109.9°
C8	N1	H1	109.1°	111.0°
C11	C8	C	109.9°	109.5°
C11	C8	C7	111.9°	109.5°
C8	C11	H10	110.6°	110.8°
C8	C11	H11	110.5°	110.8°
O	C	C8	119.5°	119.6°
O	C	N	121.9°	119.7°
C	C8	C7	115.5°	110.4°
C8	C	N	118.6°	120.7°
C8	C7	C2	114.3°	109.5°
C8	C7	H6	108.2°	109.4°
C8	C7	H7	108.2°	109.4°
C	N	C1	126.1°	120.5°
C	N	H15	117.0°	119.8°
C7	C2	C1	121.4°	119.9°
C7	C2	C3	120.1°	120.1°
C2	C7	H6	108.2°	109.4°
C2	C7	H7	108.2°	109.5°
N	C1	C2	119.2°	120.0°
N	C1	C6	120.4°	120.1°
C1	N	H15	117.0°	119.7°
C1	C2	C3	118.4°	120.0°
C2	C1	C6	120.4°	119.8°
C2	C3	C4	120.9°	120.0°
C2	C3	H14	119.5°	120.0°
C1	C6	C5	119.7°	119.9°
C1	C6	H5	120.2°	120.0°
C3	C4	C5	120.2°	120.2°
C3	C4	H3	119.9°	119.9°
C4	C3	H14	119.5°	120.0°
C6	C5	C4	120.3°	120.1°
C6	C5	H4	119.8°	120.0°
C5	C6	H5	120.1°	120.0°
C5	C4	H3	119.9°	119.9°
C4	C5	H4	119.8°	120.0°
H6	C7	H7	109.5°	109.5°
H8	C10	H9	109.5°	110.9°
H10	C11	H11	109.5°	110.7°
H12	C9	H13	109.5°	110.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C10	C9	N1	H12	119.3°	118.8°
C10	C9	N1	H13	119.3°	118.8°
C9	C10	C11	H8	119.1°	118.1°
C9	C10	C11	H9	119.1°	118.1°
C10	C9	N1	C8	16.7°	24.1°
C9	C10	C11	C8	31.7°	35.5°
C10	C9	N1	H1	136.9°	98.0°
C9	C10	H8	H9	122.6°	123.9°
C9	C10	C11	H10	151.0°	153.9°
C9	C10	C11	H11	87.6°	82.9°
C10	C9	H12	H13	121.9°	122.3°
N1	C9	C10	C11	29.7°	37.0°
C9	N1	C8	H1	120.2°	122.2°
C9	N1	C8	C11	3.1°	1.1°
C9	N1	C8	C	113.4°	118.1°
C9	N1	C8	C7	122.1°	120.2°
N1	C9	C10	H8	89.4°	81.1°
N1	C9	C10	H9	148.8°	155.1°
N1	C9	H12	H13	122.0°	122.3°
C10	C11	C8	N1	21.7°	22.1°
C10	C11	C8	H10	119.3°	118.3°
C10	C11	C8	H11	119.3°	118.4°
C10	C11	C8	C	92.9°	141.5°
C10	C11	C8	C7	137.4°	97.3°
C11	C10	H8	H9	122.6°	123.8°
C10	C11	H10	H11	122.0°	123.1°
C11	C10	C9	H12	89.6°	81.8°
C11	C10	C9	H13	149.1°	155.8°
N1	C8	C11	C	114.6°	119.4°
N1	C8	C11	C7	115.7°	119.4°
N1	C8	C	O	80.2°	24.0°
N1	C8	C	C7	119.3°	121.5°
N1	C8	C	N	99.3°	156.0°
N1	C8	C7	C2	93.3°	169.4°
N1	C8	C7	H6	145.9°	70.7°
N1	C8	C7	H7	27.4°	49.3°
N1	C8	C11	H10	141.0°	140.5°
N1	C8	C11	H11	97.6°	96.2°
C8	N1	C9	H12	102.6°	94.7°
C8	N1	C9	H13	136.1°	142.9°
C11	C8	C	O	32.8°	93.9°
C11	C8	C	C7	127.7°	120.7°
C11	C8	C	N	147.7°	86.2°
C11	C8	C7	C2	152.5°	72.8°
C11	C8	N1	H1	117.1°	121.1°
C11	C8	C7	H6	31.8°	47.2°
C11	C8	C7	H7	86.7°	167.2°
C8	C11	C10	H8	87.4°	82.6°
C8	C11	C10	H9	150.8°	153.6°
C8	C11	H10	H11	122.0°	123.3°
O	C	C8	N	179.5°	179.9°
O	C	C8	C7	160.5°	145.4°
O	C	N	C1	175.8°	179.5°
O	C	N	H15	4.3°	0.6°
C	C8	C7	C2	25.8°	47.9°
C8	C	N	C1	4.7°	0.4°
C	C8	N1	H1	126.4°	119.8°
C	C8	C7	H6	94.9°	167.9°
C	C8	C7	H7	146.6°	72.1°
C	C8	C11	H10	26.4°	100.1°
C	C8	C11	H11	147.8°	23.2°
C8	C	N	H15	175.2°	179.4°
C7	C8	C	N	20.0°	34.5°
C8	C7	C2	H6	120.7°	119.9°
C8	C7	C2	H7	120.7°	120.0°
C8	C7	C2	C1	18.7°	33.5°
C8	C7	C2	C3	165.3°	146.6°
C7	C8	N1	H1	1.9°	1.9°
C8	C7	H6	H7	117.8°	119.9°
C7	C8	C11	H10	103.3°	21.1°
C7	C8	C11	H11	18.1°	144.4°
C	N	C1	H15	180.0°	179.9°
C	N	C1	C2	4.1°	18.4°
C	N	C1	C6	176.7°	161.6°
C7	C2	C1	N	3.7°	0.0°
C7	C2	C1	C3	176.1°	179.9°
C7	C2	C1	C6	175.5°	179.9°
C7	C2	C3	C4	175.1°	179.9°
C2	C7	H6	H7	117.8°	120.0°
C7	C2	C3	H14	4.9°	0.1°
N	C1	C2	C6	179.2°	180.0°
N	C1	C2	C3	179.8°	180.0°
N	C1	C6	C5	179.1°	179.9°
N	C1	C6	H5	0.9°	0.1°
C1	C2	C3	C4	1.0°	0.0°
C2	C1	C6	C5	0.2°	0.1°
C2	C1	C6	H5	179.8°	179.9°
C1	C2	C7	H6	102.1°	153.4°
C1	C2	C7	H7	139.4°	86.5°
C1	C2	C3	H14	179.0°	180.0°
C2	C1	N	H15	176.0°	161.7°
C3	C2	C1	C6	0.5°	0.0°
C2	C3	C4	H14	180.0°	180.0°
C2	C3	C4	C5	0.8°	0.0°
C2	C3	C4	H3	179.2°	180.0°
C3	C2	C7	H6	73.9°	26.7°
C3	C2	C7	H7	44.6°	93.4°
C1	C6	C5	H5	180.0°	179.8°
C1	C6	C5	C4	0.4°	0.1°
C1	C6	C5	H4	179.6°	180.0°
C6	C1	N	H15	3.3°	18.3°
C3	C4	C5	C6	0.1°	0.1°
C3	C4	C5	H3	180.0°	180.0°
C3	C4	C5	H4	179.9°	180.0°
C6	C5	C4	H4	180.0°	179.9°
C6	C5	C4	H3	179.9°	179.9°
C4	C5	C6	H5	179.6°	180.0°
C5	C4	C3	H14	179.2°	180.0°
H1	N1	C9	H12	17.6°	143.2°
H1	N1	C9	H13	103.7°	20.8°
H3	C4	C5	H4	0.1°	0.0°
H3	C4	C3	H14	0.8°	0.0°
H4	C5	C6	H5	0.4°	0.2°
H8	C10	C11	H10	31.9°	35.8°
H8	C10	C11	H11	153.3°	158.9°
H8	C10	C9	H12	151.3°	160.1°
H8	C10	C9	H13	29.9°	37.8°
H9	C10	C11	H10	89.9°	87.9°
H9	C10	C11	H11	31.5°	35.2°
H9	C10	C9	H12	29.5°	36.3°
H9	C10	C9	H13	91.8°	86.1°

Release date:	2023-11-29
Definition date:	2023-08-29
Last modified:	2023-11-24
Release status:	REL
Processing site:	RCSB
Derived from:	7GPS