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Summary Geometry Related PDB entries

A1BL1

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
F12	C11	sing	1.40Å	1.38Å
C2	C3	doub	1.38Å	1.38Å	Aromatic
C2	C1	sing	1.38Å	1.38Å	Aromatic
C3	C4	sing	1.39Å	1.39Å	Aromatic
F13	C11	sing	1.40Å	1.40Å
C11	C1	sing	1.51Å	1.50Å
C11	F14	sing	1.40Å	1.39Å
C1	C6	doub	1.38Å	1.38Å	Aromatic
C4	N7	sing	1.40Å	1.40Å
C4	C5	doub	1.39Å	1.40Å	Aromatic
N7	C8	sing	1.35Å	1.34Å
C8	C10	sing	1.51Å	1.51Å
C8	O9	doub	1.21Å	1.23Å
C6	C5	sing	1.38Å	1.38Å	Aromatic
C2	H1	sing	1.08Å	1.08Å
C3	H2	sing	1.08Å	1.08Å
C5	H3	sing	1.08Å	1.08Å
C6	H4	sing	1.08Å	1.08Å
N7	H5	sing	0.97Å	1.00Å
C10	H6	sing	1.09Å	1.10Å
C10	H7	sing	1.09Å	1.10Å
C10	H8	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
F12	C11	F13	110.7°	109.5°
F12	C11	C1	105.8°	109.4°
F12	C11	F14	111.2°	109.5°
C3	C2	C1	120.2°	120.1°
C2	C3	C4	118.6°	119.9°
C3	C2	H1	119.9°	119.9°
C2	C3	H2	120.7°	120.1°
C2	C1	C11	116.7°	119.9°
C2	C1	C6	122.0°	120.1°
C1	C2	H1	119.9°	120.0°
C3	C4	N7	118.5°	120.1°
C3	C4	C5	120.7°	119.9°
C4	C3	H2	120.7°	120.0°
F13	C11	C1	109.3°	109.5°
F13	C11	F14	107.7°	109.4°
C1	C11	F14	112.2°	109.4°
C11	C1	C6	121.2°	119.9°
C1	C6	C5	118.1°	120.1°
C1	C6	H4	120.9°	119.9°
N7	C4	C5	120.2°	120.0°
C4	N7	C8	121.9°	120.0°
C4	N7	H5	119.1°	120.0°
C4	C5	C6	120.2°	119.9°
C4	C5	H3	119.9°	120.1°
N7	C8	C10	116.5°	120.0°
N7	C8	O9	121.7°	120.0°
C8	N7	H5	119.0°	120.0°
C10	C8	O9	121.7°	120.0°
C8	C10	H6	109.5°	109.5°
C8	C10	H7	109.5°	109.5°
C8	C10	H8	109.5°	109.5°
C6	C5	H3	119.9°	120.0°
C5	C6	H4	120.9°	120.0°
H6	C10	H7	109.5°	109.5°
H6	C10	H8	109.5°	109.5°
H7	C10	H8	109.4°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
F12	C11	C1	C2	55.2°	30.2°
F12	C11	F13	C1	116.1°	120.0°
F12	C11	F13	F14	121.8°	120.0°
F12	C11	C1	F14	121.4°	120.0°
F12	C11	C1	C6	127.3°	150.0°
C3	C2	C1	H1	180.0°	180.0°
C2	C3	C4	H2	180.0°	179.9°
C3	C2	C1	C11	177.5°	179.8°
C3	C2	C1	C6	0.0°	0.0°
C2	C3	C4	N7	178.0°	180.0°
C2	C3	C4	C5	6.9°	0.0°
C1	C2	C3	C4	4.7°	0.0°
C2	C1	C11	F13	64.1°	150.3°
C2	C1	C11	C6	177.6°	179.8°
C2	C1	C11	F14	176.6°	89.7°
C2	C1	C6	C5	2.5°	0.0°
C1	C2	C3	H2	175.3°	179.9°
C2	C1	C6	H4	177.5°	179.9°
C3	C4	N7	C5	171.2°	179.9°
C3	C4	N7	C8	134.9°	33.3°
C3	C4	C5	C6	4.4°	0.0°
C4	C3	C2	H1	175.3°	180.0°
C3	C4	C5	H3	175.6°	180.0°
C3	C4	N7	H5	45.1°	146.7°
F13	C11	C1	F14	119.4°	120.0°
F13	C11	C1	C6	113.5°	29.9°
C11	C1	C6	C5	180.0°	179.7°
C11	C1	C2	H1	2.4°	0.2°
C11	C1	C6	H4	0.0°	0.2°
F14	C11	C1	C6	5.9°	90.0°
C1	C6	C5	C4	0.3°	0.0°
C1	C6	C5	H4	180.0°	179.9°
C6	C1	C2	H1	180.0°	180.0°
C1	C6	C5	H3	179.7°	180.0°
C4	N7	C8	H5	180.0°	179.9°
C4	N7	C8	C10	177.3°	174.7°
C4	N7	C8	O9	5.3°	5.2°
N7	C4	C5	C6	175.4°	179.9°
N7	C4	C3	H2	2.0°	0.0°
N7	C4	C5	H3	4.6°	0.1°
C5	C4	N7	C8	53.9°	146.8°
C4	C5	C6	H3	180.0°	180.0°
C5	C4	C3	H2	173.1°	179.9°
C4	C5	C6	H4	179.7°	179.9°
C5	C4	N7	H5	126.1°	33.2°
N7	C8	C10	O9	177.4°	179.9°
N7	C8	C10	H6	177.4°	90.0°
N7	C8	C10	H7	62.6°	30.0°
N7	C8	C10	H8	57.4°	150.0°
C10	C8	N7	H5	2.7°	5.3°
C8	C10	H6	H7	120.0°	120.1°
C8	C10	H6	H8	120.0°	120.0°
C8	C10	H7	H8	120.0°	120.0°
O9	C8	N7	H5	174.7°	174.7°
O9	C8	C10	H6	0.0°	90.0°
O9	C8	C10	H7	120.0°	149.9°
O9	C8	C10	H8	120.0°	30.0°
H1	C2	C3	H2	4.7°	0.1°
H3	C5	C6	H4	0.3°	0.0°
H6	C10	H7	H8	120.0°	120.0°

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PDB entries from 2026-02-11

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