GKP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O8	C18	sing	1.36Å	1.36Å
C18	C17	doub	1.38Å	1.39Å	Aromatic
C18	C19	sing	1.39Å	1.48Å	Aromatic
C17	C16	sing	1.40Å	1.39Å	Aromatic
O10	C22	doub	1.21Å	1.33Å
O9	C22	sing	1.34Å	1.22Å
O7	C19	sing	1.36Å	1.36Å
C19	C20	doub	1.39Å	1.39Å	Aromatic
C16	C15	sing	1.47Å	1.48Å
C16	C21	doub	1.40Å	1.39Å	Aromatic
C15	C14	doub	1.35Å	1.33Å
C22	C12	sing	1.51Å	1.50Å
O6	C13	doub	1.22Å	1.22Å
C20	C21	sing	1.38Å	1.39Å	Aromatic
C14	C13	sing	1.42Å	1.47Å
C13	O5	sing	1.35Å	1.45Å
C12	O5	sing	1.43Å	1.42Å
C12	C10	sing	1.53Å	1.52Å
C10	O2	sing	1.43Å	1.43Å
C10	C11	sing	1.51Å	1.50Å
O2	C9	sing	1.35Å	1.45Å
C2	C1	doub	1.38Å	1.39Å	Aromatic
C2	C3	sing	1.39Å	1.39Å	Aromatic
C1	C6	sing	1.40Å	1.39Å	Aromatic
O12	C3	sing	1.36Å	1.36Å
C3	C4	doub	1.39Å	1.48Å	Aromatic
C8	C9	sing	1.42Å	1.47Å
C8	C7	doub	1.35Å	1.33Å
C9	O1	doub	1.22Å	1.22Å
C6	C7	sing	1.47Å	1.48Å
C6	C5	doub	1.40Å	1.39Å	Aromatic
C4	C5	sing	1.38Å	1.38Å	Aromatic
C4	O11	sing	1.36Å	1.36Å
C11	O3	doub	1.21Å	1.22Å
C11	O4	sing	1.34Å	1.33Å
C1	H1	sing	1.08Å	1.08Å
C10	H2	sing	1.09Å	1.10Å
C12	H3	sing	1.09Å	1.10Å
C14	H4	sing	1.08Å	1.08Å
C15	H5	sing	1.08Å	1.08Å
C17	H6	sing	1.08Å	1.08Å
C2	H7	sing	1.08Å	1.08Å
C20	H8	sing	1.08Å	1.08Å
C21	H9	sing	1.08Å	1.08Å
C5	H10	sing	1.08Å	1.08Å
C7	H11	sing	1.08Å	1.08Å
C8	H12	sing	1.08Å	1.08Å
O11	H13	sing	0.97Å	0.95Å
O12	H14	sing	0.97Å	0.95Å
O4	H15	sing	0.97Å	0.95Å
O7	H16	sing	0.97Å	0.95Å
O8	H17	sing	0.97Å	0.95Å
O9	H18	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O8	C18	C17	120.4°	119.9°
O8	C18	C19	120.5°	120.0°
C18	O8	H17	109.5°	114.0°
C17	C18	C19	119.0°	120.1°
C18	C17	C16	119.9°	119.8°
C18	C17	H6	120.1°	120.1°
C18	C19	O7	120.3°	120.0°
C18	C19	C20	119.1°	120.2°
C17	C16	C15	119.3°	120.1°
C17	C16	C21	121.1°	119.8°
C16	C17	H6	120.0°	120.1°
O10	C22	O9	119.3°	120.0°
O10	C22	C12	120.4°	120.0°
O9	C22	C12	120.3°	120.0°
C22	O9	H18	109.5°	117.0°
O7	C19	C20	120.6°	119.8°
C19	O7	H16	109.5°	114.0°
C19	C20	C21	119.7°	120.2°
C19	C20	H8	120.1°	119.9°
C15	C16	C21	119.6°	120.1°
C16	C15	C14	120.0°	120.0°
C16	C15	H5	120.0°	120.0°
C16	C21	C20	121.2°	120.0°
C16	C21	H9	119.4°	120.0°
C15	C14	C13	120.0°	120.0°
C15	C14	H4	120.0°	120.0°
C14	C15	H5	120.0°	120.0°
C22	C12	O5	107.9°	109.5°
C22	C12	C10	108.0°	109.5°
C22	C12	H3	110.6°	109.5°
O6	C13	C14	121.3°	120.0°
O6	C13	O5	119.7°	120.0°
C21	C20	H8	120.1°	119.9°
C20	C21	H9	119.4°	120.0°
C14	C13	O5	119.1°	120.0°
C13	C14	H4	120.0°	120.0°
C13	O5	C12	112.2°	117.0°
O5	C12	C10	108.2°	109.5°
O5	C12	H3	111.8°	109.5°
C12	C10	O2	107.8°	109.5°
C12	C10	C11	111.0°	109.4°
C12	C10	H2	108.9°	109.5°
C10	C12	H3	110.3°	109.5°
O2	C10	C11	109.7°	109.5°
C10	O2	C9	112.1°	117.0°
O2	C10	H2	110.3°	109.5°
C10	C11	O3	121.4°	120.0°
C10	C11	O4	119.7°	120.0°
C11	C10	H2	109.2°	109.5°
O2	C9	C8	118.9°	120.0°
O2	C9	O1	119.4°	120.0°
C1	C2	C3	119.8°	120.1°
C2	C1	C6	121.1°	120.0°
C2	C1	H1	119.5°	120.0°
C1	C2	H7	120.1°	119.9°
C2	C3	O12	121.2°	119.9°
C2	C3	C4	118.9°	120.2°
C3	C2	H7	120.1°	119.9°
C1	C6	C7	120.7°	120.1°
C1	C6	C5	120.9°	119.8°
C6	C1	H1	119.4°	120.0°
O12	C3	C4	119.9°	119.9°
C3	O12	H14	109.5°	114.0°
C3	C4	C5	119.1°	120.0°
C3	C4	O11	120.4°	120.0°
C9	C8	C7	119.7°	120.0°
C8	C9	O1	121.6°	120.0°
C9	C8	H12	120.2°	120.0°
C8	C7	C6	120.8°	120.0°
C8	C7	H11	119.6°	120.0°
C7	C8	H12	120.1°	120.0°
C7	C6	C5	118.4°	120.1°
C6	C7	H11	119.6°	120.0°
C6	C5	C4	120.1°	119.8°
C6	C5	H10	119.9°	120.1°
C5	C4	O11	120.5°	120.0°
C4	C5	H10	120.0°	120.1°
C4	O11	H13	109.5°	114.0°
O3	C11	O4	118.9°	120.0°
C11	O4	H15	109.5°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O8	C18	C17	C19	179.8°	179.9°
O8	C18	C17	C16	179.7°	180.0°
O8	C18	C19	O7	0.2°	0.1°
O8	C18	C19	C20	179.8°	179.9°
O8	C18	C17	H6	0.3°	0.0°
C18	C17	C16	H6	180.0°	179.9°
C17	C18	C19	O7	180.0°	180.0°
C17	C18	C19	C20	0.0°	0.0°
C18	C17	C16	C15	179.5°	180.0°
C18	C17	C16	C21	0.4°	0.3°
C17	C18	O8	H17	180.0°	90.1°
C19	C18	C17	C16	0.1°	0.0°
C18	C19	O7	C20	180.0°	180.0°
C18	C19	C20	C21	0.2°	0.3°
C19	C18	C17	H6	179.9°	179.9°
C18	C19	C20	H8	179.8°	180.0°
C18	C19	O7	H16	180.0°	89.9°
C19	C18	O8	H17	0.2°	90.0°
C17	C16	C15	C21	179.1°	179.7°
C17	C16	C15	C14	168.8°	179.7°
C17	C16	C21	C20	0.6°	0.6°
C17	C16	C15	H5	11.2°	0.3°
C17	C16	C21	H9	179.3°	179.7°
O10	C22	O9	C12	179.8°	180.0°
O10	C22	C12	O5	152.1°	5.0°
O10	C22	C12	C10	91.2°	115.0°
O10	C22	C12	H3	29.6°	125.0°
O10	C22	O9	H18	0.0°	0.0°
O9	C22	C12	O5	28.1°	175.0°
O9	C22	C12	C10	88.6°	65.0°
O9	C22	C12	H3	150.6°	55.0°
O7	C19	C20	C21	179.8°	179.7°
O7	C19	C20	H8	0.2°	0.0°
C19	C20	C21	C16	0.5°	0.6°
C19	C20	C21	H8	180.0°	179.6°
C19	C20	C21	H9	179.4°	179.7°
C20	C19	O7	H16	0.1°	90.1°
C16	C15	C14	H5	180.0°	180.0°
C15	C16	C21	C20	179.8°	179.7°
C16	C15	C14	C13	179.5°	180.0°
C16	C15	C14	H4	0.5°	0.0°
C15	C16	C17	H6	0.4°	0.1°
C15	C16	C21	H9	0.2°	0.0°
C21	C16	C15	C14	12.0°	0.0°
C16	C21	C20	H9	180.0°	179.7°
C21	C16	C15	H5	168.0°	180.0°
C21	C16	C17	H6	179.6°	179.8°
C16	C21	C20	H8	179.5°	179.7°
C15	C14	C13	O6	13.6°	0.0°
C15	C14	C13	H4	180.0°	180.0°
C15	C14	C13	O5	165.9°	180.0°
C22	C12	O5	C13	84.2°	90.0°
C22	C12	O5	C10	116.6°	120.0°
C22	C12	O5	H3	121.8°	120.0°
C22	C12	C10	H3	121.0°	120.0°
C22	C12	C10	O2	62.0°	55.0°
C22	C12	C10	C11	177.8°	175.0°
C22	C12	C10	H2	57.6°	65.0°
C12	C22	O9	H18	179.8°	180.0°
O6	C13	C14	O5	179.5°	180.0°
O6	C13	O5	C12	6.8°	0.1°
O6	C13	C14	H4	166.4°	180.0°
C14	C13	O5	C12	172.8°	180.0°
C13	C14	C15	H5	0.5°	0.0°
C13	O5	C12	C10	159.2°	150.0°
C13	O5	C12	H3	37.6°	29.9°
O5	C13	C14	H4	14.1°	0.0°
O5	C12	C10	H3	122.5°	120.0°
O5	C12	C10	O2	54.5°	65.0°
O5	C12	C10	C11	65.7°	55.0°
O5	C12	C10	H2	174.1°	175.0°
C12	C10	O2	C11	121.0°	120.0°
C12	C10	O2	H2	118.8°	120.0°
C12	C10	C11	H2	120.0°	120.0°
C12	C10	O2	C9	157.0°	150.1°
C12	C10	C11	O3	72.2°	115.0°
C12	C10	C11	O4	108.2°	65.0°
O2	C10	C11	H2	120.9°	120.1°
C10	O2	C9	C8	171.0°	180.0°
C10	O2	C9	O1	8.4°	0.1°
O2	C10	C11	O3	46.9°	5.0°
O2	C10	C11	O4	132.7°	175.0°
O2	C10	C12	H3	177.0°	175.0°
C11	C10	O2	C9	82.0°	90.0°
C10	C11	O3	O4	179.6°	179.9°
C11	C10	C12	H3	56.8°	65.0°
C10	C11	O4	H15	179.6°	180.0°
O2	C9	C8	O1	179.4°	179.9°
O2	C9	C8	C7	163.8°	179.9°
C9	O2	C10	H2	38.3°	30.1°
O2	C9	C8	H12	16.2°	0.0°
C1	C2	C3	H7	180.0°	179.9°
C2	C1	C6	H1	180.0°	179.7°
C1	C2	C3	O12	180.0°	180.0°
C1	C2	C3	C4	0.0°	0.1°
C2	C1	C6	C7	179.8°	179.8°
C2	C1	C6	C5	0.1°	0.0°
C3	C2	C1	C6	0.1°	0.1°
C2	C3	O12	C4	180.0°	180.0°
C2	C3	C4	C5	0.0°	0.0°
C2	C3	C4	O11	179.9°	180.0°
C3	C2	C1	H1	179.9°	179.8°
C2	C3	O12	H14	180.0°	90.0°
C1	C6	C7	C8	4.2°	0.1°
C1	C6	C7	C5	179.7°	179.8°
C1	C6	C5	C4	0.1°	0.0°
C6	C1	C2	H7	179.9°	180.0°
C1	C6	C5	H10	179.9°	180.0°
C1	C6	C7	H11	175.9°	180.0°
O12	C3	C4	C5	179.9°	180.0°
O12	C3	C4	O11	0.0°	0.0°
O12	C3	C2	H7	0.0°	0.0°
C3	C4	C5	C6	0.0°	0.0°
C3	C4	C5	O11	179.9°	180.0°
C4	C3	C2	H7	180.0°	180.0°
C3	C4	C5	H10	180.0°	180.0°
C3	C4	O11	H13	180.0°	90.0°
C4	C3	O12	H14	0.0°	90.0°
C9	C8	C7	H12	180.0°	180.0°
C9	C8	C7	C6	179.5°	180.0°
C9	C8	C7	H11	0.5°	0.0°
C7	C8	C9	O1	15.6°	0.0°
C8	C7	C6	H11	180.0°	179.9°
C8	C7	C6	C5	175.5°	179.7°
O1	C9	C8	H12	164.4°	180.0°
C7	C6	C5	C4	179.8°	179.8°
C7	C6	C1	H1	0.2°	0.1°
C7	C6	C5	H10	0.2°	0.2°
C6	C7	C8	H12	0.5°	0.1°
C6	C5	C4	H10	180.0°	180.0°
C6	C5	C4	O11	179.9°	180.0°
C5	C6	C1	H1	179.8°	179.7°
C5	C6	C7	H11	4.4°	0.2°
C5	C4	O11	H13	0.1°	90.0°
O11	C4	C5	H10	0.1°	0.0°
O3	C11	C10	H2	167.8°	125.0°
O3	C11	O4	H15	0.0°	0.0°
O4	C11	C10	H2	11.8°	54.9°
H1	C1	C2	H7	0.1°	0.3°
H2	C10	C12	H3	63.4°	55.0°
H4	C14	C15	H5	179.5°	180.0°
H8	C20	C21	H9	0.6°	0.0°
H11	C7	C8	H12	179.5°	NaN°

Release date:	2018-10-03
Definition date:	2018-05-24
Last modified:	2018-09-28
Release status:	REL
Processing site:	RCSB
Derived from:	6DIK