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Summary Geometry Related PDB entries

4HP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C8	O1	doub	1.21Å	1.25Å
C8	O2	sing	1.34Å	1.27Å
C8	C7	sing	1.51Å	1.54Å
O2	HO2	sing	0.97Å	0.95Å
C7	C1	sing	1.51Å	1.53Å
C7	H71	sing	1.09Å	1.12Å
C7	H72	sing	1.09Å	1.12Å
C1	C2	sing	1.38Å	1.40Å	Aromatic
C1	C6	doub	1.38Å	1.40Å	Aromatic
C2	C3	doub	1.38Å	1.39Å	Aromatic
C2	H2	sing	1.08Å	1.10Å
C3	C4	sing	1.39Å	1.39Å	Aromatic
C3	H3	sing	1.08Å	1.10Å
C4	C5	doub	1.39Å	1.40Å	Aromatic
C4	O4	sing	1.36Å	1.39Å
C5	C6	sing	1.38Å	1.41Å	Aromatic
C5	H5	sing	1.08Å	1.10Å
C6	H6	sing	1.08Å	1.10Å
O4	HO4	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C8	O2	123.9°	120.1°
O1	C8	C7	120.7°	119.9°
O2	C8	C7	115.2°	120.0°
C8	O2	HO2	123.8°	119.9°
C8	C7	C1	111.8°	109.5°
C8	C7	H71	111.4°	109.5°
C8	C7	H72	111.4°	109.4°
C1	C7	H71	111.3°	109.5°
C1	C7	H72	111.3°	109.4°
C7	C1	C2	121.6°	119.9°
C7	C1	C6	118.8°	119.9°
H71	C7	H72	99.0°	109.4°
C2	C1	C6	119.5°	120.1°
C1	C2	C3	120.7°	120.1°
C1	C2	H2	120.1°	120.0°
C1	C6	C5	120.0°	120.0°
C1	C6	H6	119.8°	120.0°
C3	C2	H2	119.2°	119.9°
C2	C3	C4	119.1°	119.9°
C2	C3	H3	120.4°	120.0°
C4	C3	H3	120.5°	120.1°
C3	C4	C5	121.5°	119.9°
C3	C4	O4	121.4°	120.0°
C5	C4	O4	116.9°	120.1°
C4	C5	C6	118.9°	120.0°
C4	C5	H5	120.0°	120.0°
C4	O4	HO4	121.4°	106.9°
C6	C5	H5	121.0°	120.0°
C5	C6	H6	120.2°	119.9°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C8	O2	C7	175.4°	179.9°
O1	C8	O2	HO2	180.0°	0.1°
O1	C8	C7	C1	79.5°	0.1°
O1	C8	C7	H71	155.2°	120.0°
O1	C8	C7	H72	45.8°	120.0°
O2	C8	C7	C1	96.1°	180.0°
O2	C8	C7	H71	29.2°	59.9°
O2	C8	C7	H72	138.7°	60.0°
C7	C8	O2	HO2	4.6°	180.0°
C8	C7	C1	H71	125.3°	120.1°
C8	C7	C1	H72	125.3°	120.0°
C8	C7	H71	H72	117.2°	119.9°
C8	C7	C1	C2	88.4°	90.0°
C8	C7	C1	C6	89.7°	90.2°
C1	C7	H71	H72	117.2°	120.0°
C7	C1	C2	C6	178.1°	179.8°
C7	C1	C2	C3	179.0°	180.0°
C7	C1	C2	H2	1.0°	0.0°
C7	C1	C6	C5	178.1°	179.7°
C7	C1	C6	H6	1.9°	0.1°
H71	C7	C1	C2	146.3°	30.1°
H71	C7	C1	C6	35.6°	149.7°
H72	C7	C1	C2	36.9°	150.0°
H72	C7	C1	C6	145.0°	29.8°
C1	C2	C3	H2	180.0°	180.0°
C1	C2	C3	C4	2.2°	0.0°
C1	C2	C3	H3	177.7°	180.0°
C2	C1	C6	C5	0.0°	0.5°
C2	C1	C6	H6	179.9°	179.9°
C6	C1	C2	C3	2.9°	0.2°
C6	C1	C2	H2	177.1°	179.8°
C1	C6	C5	C4	3.6°	0.5°
C1	C6	C5	H6	180.0°	179.6°
C1	C6	C5	H5	176.4°	179.8°
C2	C3	C4	H3	179.9°	180.0°
C2	C3	C4	C5	1.5°	0.0°
C2	C3	C4	O4	175.9°	180.0°
H2	C2	C3	C4	177.8°	180.0°
H2	C2	C3	H3	2.3°	0.0°
C3	C4	C5	O4	174.7°	180.0°
C3	C4	C5	C6	4.4°	0.3°
C3	C4	C5	H5	175.7°	180.0°
C3	C4	O4	HO4	180.0°	90.0°
H3	C3	C4	C5	178.6°	180.0°
H3	C3	C4	O4	4.1°	0.0°
C4	C5	C6	H5	180.0°	179.7°
C4	C5	C6	H6	176.4°	179.9°
C5	C4	O4	HO4	5.4°	90.0°
O4	C4	C5	C6	179.1°	179.7°
O4	C4	C5	H5	1.0°	0.0°
H5	C5	C6	H6	3.6°	0.2°

219140

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