L5G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	C7	doub	1.31Å	1.35Å	Aromatic
N1	N2	sing	1.40Å	1.24Å	Aromatic
N3	C10	doub	1.32Å	1.34Å	Aromatic
N3	N4	sing	1.29Å	1.24Å	Aromatic
C4	C5	doub	1.39Å	1.40Å	Aromatic
C4	C7	sing	1.48Å	1.39Å	Aromatic
C4	C3	sing	1.39Å	1.40Å	Aromatic
C5	C6	sing	1.38Å	1.39Å	Aromatic
C6	C1	doub	1.38Å	1.40Å	Aromatic
C7	C8	sing	1.41Å	1.40Å	Aromatic
C8	C9	doub	1.36Å	1.39Å	Aromatic
C10	N2	sing	1.37Å	1.39Å	Aromatic
C10	C9	sing	1.41Å	1.39Å	Aromatic
C13	C16	doub	1.41Å	1.39Å	Aromatic
C13	C14	sing	1.38Å	1.40Å	Aromatic
C13	O1	sing	1.36Å	1.37Å
C15	N5	sing	1.31Å	1.33Å	Aromatic
C15	C14	doub	1.39Å	1.40Å	Aromatic
C17	C18	sing	1.40Å	1.40Å	Aromatic
C17	C16	sing	1.42Å	1.40Å	Aromatic
C17	N5	doub	1.34Å	1.34Å	Aromatic
C20	C21	doub	1.36Å	1.39Å	Aromatic
C20	C19	sing	1.40Å	1.40Å	Aromatic
C21	C16	sing	1.40Å	1.39Å	Aromatic
C22	O2	sing	1.43Å	1.43Å
O2	C19	sing	1.36Å	1.37Å
C19	C18	doub	1.38Å	1.40Å	Aromatic
O1	C12	sing	1.43Å	1.47Å
C12	C11	sing	1.51Å	1.40Å
C11	N2	sing	1.35Å	1.39Å	Aromatic
C11	N4	doub	1.31Å	1.34Å	Aromatic
C3	C2	doub	1.38Å	1.39Å	Aromatic
C2	C1	sing	1.38Å	1.40Å	Aromatic
C5	H5	sing	1.08Å	1.08Å
C6	H6	sing	1.08Å	1.08Å
C8	H8	sing	1.08Å	1.08Å
C15	H15	sing	1.08Å	1.08Å
C20	H20	sing	1.08Å	1.08Å
C21	H21	sing	1.08Å	1.08Å
C22	H22	sing	1.09Å	1.10Å
C22	H22A	sing	1.09Å	1.10Å
C22	H22B	sing	1.09Å	1.10Å
C18	H18	sing	1.08Å	1.08Å
C14	H14	sing	1.08Å	1.08Å
C12	H12	sing	1.09Å	1.10Å
C12	H12A	sing	1.09Å	1.10Å
C9	H9	sing	1.08Å	1.08Å
C3	H3	sing	1.08Å	1.08Å
C2	H2	sing	1.08Å	1.08Å
C1	H1	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C7	N1	N2	121.9°	120.4°
N1	C7	C4	118.8°	119.6°
N1	C7	C8	120.0°	120.8°
N1	N2	C10	122.6°	120.1°
N1	N2	C11	134.3°	133.9°
C10	N3	N4	111.4°	109.2°
N3	C10	N2	107.3°	106.9°
N3	C10	C9	133.5°	133.7°
N3	N4	C11	109.7°	110.3°
C5	C4	C7	121.1°	120.1°
C5	C4	C3	119.7°	119.8°
C4	C5	C6	119.9°	119.9°
C4	C5	H5	120.1°	120.0°
C7	C4	C3	119.1°	120.1°
C4	C7	C8	121.2°	119.6°
C4	C3	C2	120.4°	119.9°
C4	C3	H3	119.8°	120.1°
C5	C6	C1	120.2°	120.2°
C6	C5	H5	120.1°	120.1°
C5	C6	H6	119.9°	119.9°
C6	C1	C2	120.2°	120.2°
C1	C6	H6	119.9°	119.9°
C6	C1	H1	119.9°	119.9°
C7	C8	C9	119.1°	120.1°
C7	C8	H8	120.4°	120.0°
C8	C9	C10	117.1°	119.2°
C9	C8	H8	120.5°	120.0°
C8	C9	H9	121.5°	120.4°
N2	C10	C9	119.2°	119.4°
C10	N2	C11	103.1°	106.0°
C10	C9	H9	121.5°	120.4°
C16	C13	C14	118.2°	118.0°
C16	C13	O1	119.7°	121.0°
C13	C16	C17	119.7°	118.9°
C13	C16	C21	120.4°	121.2°
C14	C13	O1	122.1°	121.0°
C13	C14	C15	119.7°	119.7°
C13	C14	H14	120.1°	120.1°
C13	O1	C12	116.8°	117.0°
N5	C15	C14	120.7°	121.8°
C15	N5	C17	121.8°	121.6°
N5	C15	H15	119.7°	119.1°
C14	C15	H15	119.7°	119.1°
C15	C14	H14	120.2°	120.1°
C18	C17	C16	120.2°	119.1°
C18	C17	N5	119.8°	120.9°
C17	C18	C19	119.8°	119.7°
C17	C18	H18	120.1°	120.2°
C16	C17	N5	120.0°	120.0°
C17	C16	C21	119.9°	119.9°
C21	C20	C19	120.9°	120.8°
C20	C21	C16	119.8°	119.8°
C21	C20	H20	119.6°	119.6°
C20	C21	H21	120.1°	120.1°
C20	C19	O2	117.2°	119.6°
C20	C19	C18	119.5°	120.8°
C19	C20	H20	119.6°	119.6°
C16	C21	H21	120.1°	120.1°
C22	O2	C19	118.0°	117.0°
O2	C22	H22	109.5°	109.5°
O2	C22	H22A	109.5°	109.5°
O2	C22	H22B	109.4°	109.5°
O2	C19	C18	123.3°	119.6°
C19	C18	H18	120.1°	120.2°
O1	C12	C11	121.0°	109.5°
O1	C12	H12	105.8°	109.4°
O1	C12	H12A	103.1°	109.5°
C12	C11	N2	125.8°	126.1°
C12	C11	N4	125.7°	126.2°
C11	C12	H12	105.8°	109.5°
C11	C12	H12A	103.1°	109.5°
N2	C11	N4	108.5°	107.7°
C3	C2	C1	119.6°	120.1°
C2	C3	H3	119.8°	120.0°
C3	C2	H2	120.2°	120.0°
C1	C2	H2	120.2°	119.9°
C2	C1	H1	120.0°	119.9°
H22	C22	H22A	109.5°	109.5°
H22	C22	H22B	109.5°	109.4°
H22A	C22	H22B	109.5°	109.5°
H12	C12	H12A	119.0°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1	C7	C4	C5	175.8°	0.1°
N1	C7	C4	C8	179.2°	179.9°
N1	C7	C4	C3	2.9°	179.7°
N1	C7	C8	C9	0.2°	0.0°
C7	N1	N2	C10	0.5°	0.0°
C7	N1	N2	C11	180.0°	180.0°
N1	C7	C8	H8	179.8°	179.9°
N1	N2	C10	N3	179.9°	180.0°
N2	N1	C7	C4	179.7°	180.0°
N2	N1	C7	C8	0.5°	0.1°
N1	N2	C10	C11	179.6°	180.0°
N1	N2	C10	C9	0.2°	0.0°
N1	N2	C11	C12	0.4°	0.0°
N1	N2	C11	N4	179.7°	180.0°
N3	C10	C9	C8	179.7°	180.0°
N3	C10	N2	C9	179.9°	180.0°
N3	C10	N2	C11	0.3°	0.0°
C10	N3	N4	C11	0.2°	0.1°
N3	C10	C9	H9	0.3°	0.0°
N4	N3	C10	N2	0.3°	0.0°
N4	N3	C10	C9	179.8°	180.0°
N3	N4	C11	C12	179.8°	180.0°
N3	N4	C11	N2	0.0°	0.1°
C5	C4	C7	C3	178.7°	179.8°
C4	C5	C6	H5	180.0°	180.0°
C4	C5	C6	C1	0.0°	0.1°
C5	C4	C7	C8	3.4°	180.0°
C5	C4	C3	C2	0.7°	0.0°
C4	C5	C6	H6	180.0°	180.0°
C5	C4	C3	H3	179.3°	180.0°
C7	C4	C5	C6	179.1°	180.0°
C4	C7	C8	C9	179.4°	180.0°
C7	C4	C3	C2	179.5°	179.8°
C7	C4	C5	H5	0.9°	0.0°
C4	C7	C8	H8	0.6°	0.0°
C7	C4	C3	H3	0.5°	0.2°
C3	C4	C5	C6	0.4°	0.3°
C3	C4	C7	C8	177.9°	0.2°
C4	C3	C2	H3	180.0°	180.0°
C4	C3	C2	C1	0.6°	0.4°
C3	C4	C5	H5	179.6°	179.7°
C4	C3	C2	H2	179.4°	179.9°
C5	C6	C1	H6	180.0°	179.9°
C5	C6	C1	C2	0.2°	0.3°
C5	C6	C1	H1	179.8°	179.9°
C6	C1	C2	C3	0.1°	0.6°
C6	C1	C2	H1	180.0°	179.6°
C1	C6	C5	H5	179.9°	179.9°
C6	C1	C2	H2	179.9°	179.8°
C7	C8	C9	H8	180.0°	180.0°
C7	C8	C9	C10	0.1°	0.0°
C7	C8	C9	H9	179.9°	180.0°
C8	C9	C10	N2	0.1°	0.0°
C8	C9	C10	H9	180.0°	180.0°
C10	N2	C11	C12	180.0°	180.0°
C10	N2	C11	N4	0.2°	0.0°
N2	C10	C9	H9	179.9°	179.9°
C9	C10	N2	C11	179.8°	180.0°
C10	C9	C8	H8	179.9°	180.0°
C16	C13	C14	O1	179.4°	179.8°
C16	C13	C14	C15	0.3°	0.1°
C13	C16	C17	C18	179.8°	179.9°
C13	C16	C17	C21	179.9°	179.9°
C13	C16	C17	N5	0.1°	0.1°
C13	C16	C21	C20	179.5°	180.0°
C16	C13	O1	C12	164.8°	180.0°
C13	C16	C21	H21	0.5°	0.1°
C16	C13	C14	H14	179.7°	180.0°
C13	C14	C15	N5	0.3°	0.0°
C13	C14	C15	H14	180.0°	180.0°
C14	C13	C16	C17	0.2°	0.1°
C14	C13	C16	C21	179.9°	180.0°
C14	C13	O1	C12	15.8°	0.2°
C13	C14	C15	H15	179.6°	180.0°
O1	C13	C14	C15	179.7°	179.8°
O1	C13	C16	C17	179.6°	179.7°
O1	C13	C16	C21	0.5°	0.1°
C13	O1	C12	C11	77.5°	179.9°
O1	C13	C14	H14	0.3°	0.2°
C13	O1	C12	H12	42.5°	60.0°
C13	O1	C12	H12A	168.2°	59.9°
N5	C15	C14	H15	180.0°	180.0°
C15	N5	C17	C18	179.8°	180.0°
C15	N5	C17	C16	0.1°	0.0°
N5	C15	C14	H14	179.6°	180.0°
C14	C15	N5	C17	0.2°	0.0°
C18	C17	C16	N5	179.9°	180.0°
C17	C18	C19	C20	0.3°	0.0°
C18	C17	C16	C21	0.1°	0.1°
C17	C18	C19	O2	179.9°	180.0°
C17	C18	C19	H18	180.0°	180.0°
C17	C16	C21	C20	0.5°	0.1°
C16	C17	C18	C19	0.0°	0.0°
C17	C16	C21	H21	179.6°	180.0°
C16	C17	C18	H18	180.0°	180.0°
N5	C17	C16	C21	180.0°	180.0°
N5	C17	C18	C19	179.9°	180.0°
C17	N5	C15	H15	179.7°	180.0°
N5	C17	C18	H18	0.1°	0.0°
C21	C20	C19	H20	180.0°	179.9°
C20	C21	C16	H21	180.0°	179.9°
C21	C20	C19	O2	179.7°	180.0°
C21	C20	C19	C18	0.6°	0.1°
C19	C20	C21	C16	0.7°	0.1°
C20	C19	O2	C22	178.8°	0.0°
C20	C19	O2	C18	179.7°	180.0°
C19	C20	C21	H21	179.3°	180.0°
C20	C19	C18	H18	179.7°	180.0°
C16	C21	C20	H20	179.2°	179.9°
C22	O2	C19	C18	1.5°	180.0°
O2	C22	H22	H22A	120.0°	120.1°
O2	C22	H22	H22B	120.0°	120.0°
O2	C22	H22A	H22B	120.0°	120.0°
O2	C19	C20	H20	0.4°	0.0°
C19	O2	C22	H22	50.7°	60.1°
C19	O2	C22	H22A	69.3°	60.0°
C19	O2	C22	H22B	170.7°	180.0°
O2	C19	C18	H18	0.0°	0.0°
C18	C19	C20	H20	179.3°	180.0°
O1	C12	C11	H12	120.0°	120.0°
O1	C12	C11	H12A	114.3°	120.0°
O1	C12	C11	N2	36.7°	90.0°
O1	C12	C11	N4	143.1°	90.1°
O1	C12	H12	H12A	115.3°	119.9°
C12	C11	N2	N4	179.8°	179.9°
C11	C12	H12	H12A	115.2°	120.0°
N2	C11	C12	H12	156.7°	30.0°
N2	C11	C12	H12A	77.6°	150.0°
N4	C11	C12	H12	23.1°	150.0°
N4	C11	C12	H12A	102.6°	30.0°
C3	C2	C1	H2	180.0°	179.6°
C3	C2	C1	H1	179.9°	179.8°
C2	C1	C6	H6	179.8°	179.6°
C1	C2	C3	H3	179.4°	179.6°
H5	C5	C6	H6	0.1°	0.0°
H6	C6	C1	H1	0.2°	0.1°
H8	C8	C9	H9	0.1°	0.0°
H15	C15	C14	H14	0.4°	0.0°
H20	C20	C21	H21	0.8°	0.0°
H22	C22	H22A	H22B	120.0°	119.9°
H3	C3	C2	H2	0.6°	0.0°
H2	C2	C1	H1	0.1°	0.2°

Definition date:	2008-03-02
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	3CD8