A1PRG

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C7	C8	sing	1.53Å	1.53Å
C7	C6	sing	1.53Å	1.53Å
C8	C9	sing	1.53Å	1.54Å
C6	C5	sing	1.53Å	1.54Å
C9	C4	sing	1.53Å	1.55Å
C9	O2	sing	1.43Å	1.42Å
C5	C4	sing	1.53Å	1.55Å
C4	C3	sing	1.53Å	1.54Å
C3	C2	sing	1.53Å	1.54Å
C2	N1	sing	1.47Å	1.46Å
O1	C1	doub	1.22Å	1.23Å
N1	C1	sing	1.35Å	1.34Å
C1	C10	sing	1.47Å	1.51Å
C10	C11	doub	1.38Å	1.39Å	Aromatic
C10	N4	sing	1.37Å	1.38Å	Aromatic
C11	C12	sing	1.40Å	1.42Å	Aromatic
N3	N4	sing	1.40Å	1.37Å	Aromatic
N3	C15	doub	1.31Å	1.33Å	Aromatic
N4	C14	sing	1.37Å	1.41Å	Aromatic
C12	C13	doub	1.36Å	1.38Å	Aromatic
C15	N2	sing	1.32Å	1.36Å	Aromatic
C14	C13	sing	1.41Å	1.42Å	Aromatic
C14	N2	doub	1.33Å	1.33Å	Aromatic
C13	H19	sing	1.08Å	1.08Å
C15	H20	sing	1.08Å	1.08Å
C11	H17	sing	1.08Å	1.08Å
C12	H18	sing	1.08Å	1.08Å
C2	H2	sing	1.09Å	1.10Å
C2	H3	sing	1.09Å	1.10Å
C3	H5	sing	1.09Å	1.10Å
C3	H4	sing	1.09Å	1.10Å
C4	H6	sing	1.09Å	1.10Å
C5	H7	sing	1.09Å	1.10Å
C5	H8	sing	1.09Å	1.10Å
C6	H10	sing	1.09Å	1.10Å
C6	H9	sing	1.09Å	1.10Å
C7	H11	sing	1.09Å	1.10Å
C7	H12	sing	1.09Å	1.10Å
C8	H13	sing	1.09Å	1.10Å
C8	H14	sing	1.09Å	1.10Å
C9	H15	sing	1.09Å	1.10Å
N1	H1	sing	0.97Å	1.00Å
O2	H16	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C8	C7	C6	110.4°	109.5°
C7	C8	C9	112.4°	109.5°
C8	C7	H11	109.2°	109.5°
C8	C7	H12	109.2°	109.5°
C7	C8	H13	108.7°	109.5°
C7	C8	H14	108.8°	109.5°
C7	C6	C5	111.5°	109.5°
C7	C6	H10	108.9°	109.5°
C7	C6	H9	108.9°	109.5°
C6	C7	H11	109.3°	109.4°
C6	C7	H12	109.3°	109.5°
C8	C9	C4	112.3°	109.5°
C8	C9	O2	109.5°	109.4°
C9	C8	H13	108.7°	109.5°
C9	C8	H14	108.7°	109.5°
C8	C9	H15	107.5°	109.5°
C6	C5	C4	112.3°	109.4°
C6	C5	H7	108.7°	109.5°
C6	C5	H8	108.7°	109.4°
C5	C6	H10	108.9°	109.5°
C5	C6	H9	109.0°	109.4°
C4	C9	O2	110.8°	109.5°
C9	C4	C5	111.3°	109.5°
C9	C4	C3	112.6°	109.4°
C9	C4	H6	106.9°	109.5°
C4	C9	H15	107.4°	109.5°
O2	C9	H15	109.1°	109.5°
C9	O2	H16	109.5°	114.1°
C5	C4	C3	111.7°	109.4°
C5	C4	H6	106.9°	109.5°
C4	C5	H7	108.7°	109.5°
C4	C5	H8	108.8°	109.5°
C4	C3	C2	116.1°	109.5°
C4	C3	H5	107.8°	109.5°
C4	C3	H4	107.8°	109.5°
C3	C4	H6	107.0°	109.5°
C3	C2	N1	110.6°	109.5°
C3	C2	H2	109.2°	109.5°
C3	C2	H3	109.2°	109.5°
C2	C3	H5	107.8°	109.4°
C2	C3	H4	107.8°	109.4°
C2	N1	C1	125.2°	120.0°
N1	C2	H2	109.2°	109.5°
N1	C2	H3	109.2°	109.5°
C2	N1	H1	117.4°	120.0°
O1	C1	N1	122.6°	120.0°
O1	C1	C10	121.1°	120.0°
N1	C1	C10	116.3°	120.0°
C1	N1	H1	117.4°	120.0°
C1	C10	C11	119.6°	119.9°
C1	C10	N4	122.3°	119.9°
C11	C10	N4	118.1°	120.2°
C10	C11	C12	121.2°	119.9°
C10	C11	H17	119.4°	120.1°
C10	N4	N3	128.5°	133.3°
C10	N4	C14	122.6°	120.5°
C11	C12	C13	120.1°	119.8°
C12	C11	H17	119.4°	120.0°
C11	C12	H18	119.9°	120.1°
N4	N3	C15	102.5°	107.1°
N3	N4	C14	108.9°	106.2°
N3	C15	N2	116.1°	109.6°
N3	C15	H20	122.0°	125.2°
N4	C14	C13	118.2°	119.9°
N4	C14	N2	108.8°	107.4°
C12	C13	C14	119.7°	119.7°
C12	C13	H19	120.1°	120.2°
C13	C12	H18	119.9°	120.1°
C15	N2	C14	103.7°	109.7°
N2	C15	H20	122.0°	125.2°
C13	C14	N2	133.0°	132.7°
C14	C13	H19	120.1°	120.2°
H2	C2	H3	109.4°	109.4°
H5	C3	H4	109.5°	109.5°
H7	C5	H8	109.5°	109.5°
H10	C6	H9	109.5°	109.5°
H11	C7	H12	109.5°	109.4°
H13	C8	H14	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C8	C7	C6	H11	120.1°	120.0°
C8	C7	C6	H12	120.1°	120.1°
C7	C8	C9	H13	120.4°	120.0°
C7	C8	C9	H14	120.5°	120.0°
C8	C7	C6	C5	56.6°	60.1°
C7	C8	C9	C4	53.3°	60.0°
C7	C8	C9	O2	70.3°	60.0°
C8	C7	C6	H10	176.9°	60.0°
C8	C7	C6	H9	63.8°	180.0°
C8	C7	H11	H12	119.6°	120.0°
C7	C8	H13	H14	118.7°	120.0°
C7	C8	C9	H15	171.3°	180.0°
C6	C7	C8	C9	55.7°	60.0°
C7	C6	C5	H10	120.3°	120.0°
C7	C6	C5	H9	120.3°	120.0°
C7	C6	C5	C4	55.6°	60.0°
C7	C6	C5	H7	64.8°	180.0°
C7	C6	C5	H8	176.0°	60.0°
C7	C6	H10	H9	119.0°	120.0°
C6	C7	H11	H12	119.6°	120.0°
C6	C7	C8	H13	64.8°	60.0°
C6	C7	C8	H14	176.1°	180.0°
C8	C9	C4	O2	122.8°	120.0°
C8	C9	C4	H15	118.0°	120.0°
C8	C9	O2	H15	117.5°	120.0°
C8	C9	C4	C5	50.7°	60.0°
C8	C9	C4	C3	177.1°	180.0°
C8	C9	C4	H6	65.8°	60.0°
C9	C8	C7	H11	64.5°	180.0°
C9	C8	C7	H12	175.8°	60.1°
C9	C8	H13	H14	118.6°	120.0°
C8	C9	O2	H16	180.0°	59.9°
C6	C5	C4	C9	52.0°	60.0°
C6	C5	C4	H7	120.4°	120.0°
C6	C5	C4	H8	120.4°	120.0°
C6	C5	C4	C3	178.9°	180.0°
C6	C5	C4	H6	64.4°	60.0°
C6	C5	H7	H8	118.7°	120.0°
C5	C6	H10	H9	119.1°	120.0°
C5	C6	C7	H11	63.5°	179.9°
C5	C6	C7	H12	176.7°	60.0°
C4	C9	O2	H15	118.1°	120.0°
C9	C4	C5	C3	126.9°	119.9°
C9	C4	C5	H6	116.4°	120.0°
C9	C4	C3	H6	117.1°	120.0°
C9	C4	C3	C2	172.2°	175.0°
C9	C4	C3	H5	51.2°	65.0°
C9	C4	C3	H4	66.9°	55.1°
C9	C4	C5	H7	68.4°	180.0°
C9	C4	C5	H8	172.4°	59.9°
C4	C9	C8	H13	67.1°	60.0°
C4	C9	C8	H14	173.8°	180.0°
C4	C9	O2	H16	55.6°	179.9°
O2	C9	C4	C5	72.1°	59.9°
O2	C9	C4	C3	54.3°	60.0°
O2	C9	C4	H6	171.4°	180.0°
O2	C9	C8	H13	169.3°	179.9°
O2	C9	C8	H14	50.2°	60.0°
C5	C4	C3	H6	116.7°	120.0°
C5	C4	C3	C2	61.6°	65.0°
C5	C4	C3	H5	177.4°	54.9°
C5	C4	C3	H4	59.3°	175.0°
C4	C5	H7	H8	118.7°	120.1°
C4	C5	C6	H10	175.9°	60.0°
C4	C5	C6	H9	64.7°	180.0°
C5	C4	C9	H15	168.7°	180.0°
C4	C3	C2	H5	121.0°	120.0°
C4	C3	C2	H4	121.0°	120.0°
C4	C3	C2	N1	178.3°	180.0°
C4	C3	C2	H2	58.1°	60.0°
C4	C3	C2	H3	61.5°	59.9°
C4	C3	H5	H4	117.0°	120.1°
C3	C4	C5	H7	58.5°	60.1°
C3	C4	C5	H8	60.7°	60.0°
C3	C4	C9	H15	64.9°	60.1°
C3	C2	N1	H2	120.2°	120.0°
C3	C2	N1	H3	120.2°	120.0°
C3	C2	N1	C1	106.4°	180.0°
C3	C2	H2	H3	119.5°	120.0°
C2	C3	H5	H4	117.0°	120.0°
C2	C3	C4	H6	55.0°	55.0°
C3	C2	N1	H1	73.6°	0.0°
C2	N1	C1	O1	0.3°	0.0°
C2	N1	C1	H1	180.0°	180.0°
C2	N1	C1	C10	179.2°	180.0°
N1	C2	H2	H3	119.5°	120.0°
N1	C2	C3	H5	60.7°	60.0°
N1	C2	C3	H4	57.3°	60.0°
O1	C1	N1	C10	178.9°	179.9°
O1	C1	C10	C11	33.6°	0.1°
O1	C1	C10	N4	146.9°	179.7°
O1	C1	N1	H1	179.7°	180.0°
N1	C1	C10	C11	145.3°	180.0°
N1	C1	C10	N4	34.2°	0.2°
C1	N1	C2	H2	133.4°	60.0°
C1	N1	C2	H3	13.8°	60.0°
C1	C10	C11	N4	179.5°	179.8°
C1	C10	C11	C12	179.9°	180.0°
C1	C10	N4	N3	0.7°	0.2°
C1	C10	N4	C14	179.9°	180.0°
C1	C10	C11	H17	0.1°	0.0°
C10	C1	N1	H1	0.8°	0.1°
C10	C11	C12	H17	180.0°	180.0°
C11	C10	N4	N3	179.8°	180.0°
C11	C10	N4	C14	0.4°	0.2°
C10	C11	C12	C13	0.6°	0.0°
C10	C11	C12	H18	179.4°	180.0°
N4	C10	C11	C12	0.5°	0.2°
C10	N4	N3	C14	179.5°	179.8°
C10	N4	N3	C15	179.9°	179.9°
C10	N4	C14	C13	0.2°	0.0°
C10	N4	C14	N2	180.0°	180.0°
N4	C10	C11	H17	179.5°	179.7°
C11	C12	C13	H18	180.0°	180.0°
C11	C12	C13	C14	0.4°	0.2°
C11	C12	C13	H19	179.6°	180.0°
N4	N3	C15	N2	0.2°	0.3°
N3	N4	C14	C13	179.7°	179.8°
N3	N4	C14	N2	0.4°	0.2°
N4	N3	C15	H20	179.8°	179.9°
C15	N3	N4	C14	0.4°	0.3°
N3	C15	N2	H20	180.0°	179.8°
N3	C15	N2	C14	0.0°	0.2°
N4	C14	C13	C12	0.2°	0.2°
N4	C14	N2	C15	0.2°	0.0°
N4	C14	C13	N2	179.8°	180.0°
N4	C14	C13	H19	179.8°	180.0°
C12	C13	C14	H19	180.0°	179.8°
C12	C13	C14	N2	180.0°	179.8°
C13	C12	C11	H17	179.4°	180.0°
C15	N2	C14	C13	179.9°	180.0°
C14	C13	C12	H18	179.6°	179.8°
N2	C14	C13	H19	0.0°	0.0°
C14	N2	C15	H20	180.0°	180.0°
H19	C13	C12	H18	0.4°	0.0°
H17	C11	C12	H18	0.6°	0.0°
H2	C2	C3	H5	179.1°	60.0°
H2	C2	C3	H4	62.8°	180.0°
H2	C2	N1	H1	46.5°	120.1°
H3	C2	C3	H5	59.4°	180.0°
H3	C2	C3	H4	177.5°	60.0°
H3	C2	N1	H1	166.2°	120.0°
H5	C3	C4	H6	65.9°	175.0°
H4	C3	C4	H6	176.0°	64.9°
H6	C4	C5	H7	175.2°	60.0°
H6	C4	C5	H8	56.0°	179.9°
H6	C4	C9	H15	52.3°	60.0°
H7	C5	C6	H10	55.5°	60.0°
H7	C5	C6	H9	174.9°	60.0°
H8	C5	C6	H10	63.7°	180.0°
H8	C5	C6	H9	55.7°	60.0°
H10	C6	C7	H11	56.7°	60.0°
H10	C6	C7	H12	63.0°	180.0°
H9	C6	C7	H11	176.1°	60.0°
H9	C6	C7	H12	56.3°	59.9°
H11	C7	C8	H13	175.1°	60.0°
H11	C7	C8	H14	56.0°	60.0°
H12	C7	C8	H13	55.4°	179.9°
H12	C7	C8	H14	63.8°	59.9°
H13	C8	C9	H15	50.8°	60.0°
H14	C8	C9	H15	68.3°	60.0°
H15	C9	O2	H16	62.5°	60.0°

Release date:	2026-11-04
Definition date:	2026-09-04
Last modified:	2026-10-30
Release status:	REL
Processing site:	RCSB
Derived from:	15RP