IME

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CU	O1	sing	0.00Å	2.54Å
CU	O2	sing	0.00Å	2.52Å
CU	NEC	sing	0.00Å	2.02Å
CU	NEM	sing	0.00Å	2.00Å
CU	NEW	sing	0.00Å	2.00Å
CU	NE6	sing	0.00Å	1.96Å
O1	HO1	sing	0.00Å	0.95Å
O2	HO2	sing	0.00Å	0.95Å
CG1	CDC	doub	0.00Å	1.35Å	Aromatic
CG1	NDB	sing	0.00Å	1.38Å	Aromatic
CG1	HG1	sing	0.00Å	1.08Å
CDC	NEC	sing	0.00Å	1.37Å	Aromatic
CDC	HD21	sing	0.00Å	1.08Å
NDB	CEB	doub	0.00Å	1.32Å	Aromatic
CEB	NEC	sing	0.00Å	1.32Å	Aromatic
CEB	HE11	sing	0.00Å	1.08Å
CG2	CDM	doub	0.00Å	1.35Å	Aromatic
CG2	NDL	sing	0.00Å	1.38Å	Aromatic
CG2	HG2	sing	0.00Å	1.08Å
CDM	NEM	sing	0.00Å	1.38Å	Aromatic
CDM	HD22	sing	0.00Å	1.08Å
NDL	CEL	doub	0.00Å	1.32Å	Aromatic
CEL	NEM	sing	0.00Å	1.32Å	Aromatic
CEL	HE12	sing	0.00Å	1.08Å
CG3	CDW	doub	0.00Å	1.35Å	Aromatic
CG3	NDV	sing	0.00Å	1.38Å	Aromatic
CG3	HG3	sing	0.00Å	1.08Å
CDW	NEW	sing	0.00Å	1.37Å	Aromatic
CDW	HD23	sing	0.00Å	1.08Å
NDV	CEV	doub	0.00Å	1.32Å	Aromatic
CEV	NEW	sing	0.00Å	1.32Å	Aromatic
CEV	HE13	sing	0.00Å	1.08Å
CG4	CD6	doub	0.00Å	1.35Å	Aromatic
CG4	ND5	sing	0.00Å	1.38Å	Aromatic
CG4	HG4	sing	0.00Å	1.08Å
CD6	NE6	sing	0.00Å	1.37Å	Aromatic
CD6	HD24	sing	0.00Å	1.08Å
ND5	CE5	doub	0.00Å	1.32Å	Aromatic
CE5	NE6	sing	0.00Å	1.32Å	Aromatic
CE5	HE14	sing	0.00Å	1.08Å
O1	H15	sing	0.00Å	0.95Å
O2	H16	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	CU	O2	171.6°	90.0°
O1	CU	NEC	97.6°	90.0°
O1	CU	NEM	97.4°	90.0°
O1	CU	NEW	84.1°	90.0°
O1	CU	NE6	90.3°	90.0°
CU	O1	HO1	109.5°	90.0°
CU	O1	H15	109.5°	90.0°
O2	CU	NEC	90.6°	90.0°
O2	CU	NEM	81.4°	90.0°
O2	CU	NEW	87.6°	90.0°
O2	CU	NE6	92.4°	90.0°
CU	O2	HO2	109.5°	90.0°
CU	O2	H16	109.5°	90.0°
NEC	CU	NEM	87.6°	90.0°
NEC	CU	NEW	178.2°	90.0°
NEC	CU	NE6	82.0°	90.0°
CU	NEC	CDC	125.3°	90.0°
CU	NEC	CEB	128.9°	90.0°
NEM	CU	NEW	91.6°	90.0°
NEM	CU	NE6	167.9°	90.0°
CU	NEM	CDM	131.1°	90.0°
CU	NEM	CEL	130.8°	90.0°
NEW	CU	NE6	98.6°	90.0°
CU	NEW	CDW	123.5°	90.0°
CU	NEW	CEV	131.9°	90.0°
CU	NE6	CD6	147.3°	90.0°
CU	NE6	CE5	123.0°	90.0°
HO1	O1	H15	109.5°	90.0°
HO2	O2	H16	109.5°	90.0°
CDC	CG1	NDB	107.3°	90.0°
CDC	CG1	HG1	126.4°	90.0°
CG1	CDC	NEC	108.5°	90.0°
CG1	CDC	HD21	125.7°	90.0°
NDB	CG1	HG1	126.3°	90.0°
CG1	NDB	CEB	106.3°	90.0°
NEC	CDC	HD21	125.8°	90.0°
CDC	NEC	CEB	105.6°	90.0°
NDB	CEB	NEC	112.3°	90.0°
NDB	CEB	HE11	123.8°	90.0°
NEC	CEB	HE11	123.9°	90.0°
CDM	CG2	NDL	106.7°	90.0°
CDM	CG2	HG2	126.7°	90.0°
CG2	CDM	NEM	113.4°	90.0°
CG2	CDM	HD22	123.3°	90.0°
NDL	CG2	HG2	126.7°	90.0°
CG2	NDL	CEL	101.6°	90.0°
NEM	CDM	HD22	123.3°	90.0°
CDM	NEM	CEL	97.7°	90.0°
NDL	CEL	NEM	120.6°	90.0°
NDL	CEL	HE12	119.7°	90.0°
NEM	CEL	HE12	119.7°	90.0°
CDW	CG3	NDV	110.6°	90.0°
CDW	CG3	HG3	124.7°	90.0°
CG3	CDW	NEW	106.9°	90.0°
CG3	CDW	HD23	126.6°	90.0°
NDV	CG3	HG3	124.7°	90.0°
CG3	NDV	CEV	102.2°	90.0°
NEW	CDW	HD23	126.5°	90.0°
CDW	NEW	CEV	104.5°	90.0°
NDV	CEV	NEW	115.8°	90.0°
NDV	CEV	HE13	122.1°	90.0°
NEW	CEV	HE13	122.1°	90.0°
CD6	CG4	ND5	99.3°	90.0°
CD6	CG4	HG4	130.4°	90.0°
CG4	CD6	NE6	123.2°	90.0°
CG4	CD6	HD24	118.4°	90.0°
ND5	CG4	HG4	130.4°	90.0°
CG4	ND5	CE5	103.4°	90.0°
NE6	CD6	HD24	118.4°	90.0°
CD6	NE6	CE5	89.6°	90.0°
ND5	CE5	NE6	124.5°	90.0°
ND5	CE5	HE14	117.7°	90.0°
NE6	CE5	HE14	117.7°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	CU	O2	NEC	169.7°	90.0°
O1	CU	O2	NEM	82.2°	90.0°
O1	CU	O2	NEW	9.7°	90.0°
O1	CU	O2	NE6	108.2°	90.0°
O1	CU	NEC	NEM	97.1°	90.0°
O1	CU	NEC	NEW	160.4°	90.0°
O1	CU	NEC	NE6	89.2°	90.0°
O1	CU	NEM	NEW	84.2°	90.0°
O1	CU	NEM	NE6	128.8°	90.0°
O1	CU	NEW	NE6	89.4°	90.0°
CU	O1	HO1	H15	120.0°	90.0°
O1	CU	O2	HO2	180.0°	90.0°
O1	CU	NEC	CDC	7.2°	90.0°
O1	CU	NEC	CEB	178.4°	90.0°
O1	CU	NEM	CDM	139.3°	90.0°
O1	CU	NEM	CEL	49.1°	90.0°
O1	CU	NEW	CDW	169.4°	90.0°
O1	CU	NEW	CEV	8.7°	90.0°
O1	CU	NE6	CD6	146.0°	90.0°
O1	CU	NE6	CE5	36.5°	90.0°
O1	CU	O2	H16	60.0°	90.0°
O2	CU	NEC	NEM	81.3°	90.0°
O2	CU	NEC	NEW	18.1°	90.0°
O2	CU	NEC	NE6	92.3°	90.0°
O2	CU	NEM	NEW	87.4°	90.0°
O2	CU	NEM	NE6	59.6°	90.0°
O2	CU	NEW	NE6	92.0°	90.0°
O2	CU	O1	HO1	180.0°	90.0°
CU	O2	HO2	H16	120.0°	90.0°
O2	CU	NEC	CDC	171.3°	90.0°
O2	CU	NEC	CEB	3.1°	90.0°
O2	CU	NEM	CDM	32.3°	90.0°
O2	CU	NEM	CEL	139.3°	90.0°
O2	CU	NEW	CDW	12.0°	90.0°
O2	CU	NEW	CEV	169.9°	90.0°
O2	CU	NE6	CD6	42.0°	90.0°
O2	CU	NE6	CE5	135.5°	90.0°
O2	CU	O1	H15	60.0°	90.0°
NEC	CU	NEM	NEW	178.4°	90.0°
NEC	CU	NEM	NE6	31.4°	90.0°
NEC	CU	NEW	NE6	110.2°	90.0°
NEC	CU	O1	HO1	10.4°	90.0°
NEC	CU	O2	HO2	10.2°	90.0°
CU	NEC	CDC	CG1	175.4°	90.0°
CU	NEC	CDC	CEB	175.5°	90.0°
CU	NEC	CDC	HD21	4.6°	90.0°
CU	NEC	CEB	NDB	175.3°	90.0°
CU	NEC	CEB	HE11	4.8°	90.0°
NEC	CU	NEM	CDM	123.3°	90.0°
NEC	CU	NEM	CEL	48.3°	90.0°
NEC	CU	NEW	CDW	30.1°	90.0°
NEC	CU	NEW	CEV	151.7°	90.0°
NEC	CU	NE6	CD6	48.4°	90.0°
NEC	CU	NE6	CE5	134.1°	90.0°
NEC	CU	O1	H15	109.6°	90.0°
NEC	CU	O2	H16	130.3°	90.0°
NEM	CU	NEW	NE6	173.3°	90.0°
NEM	CU	O1	HO1	99.0°	90.0°
NEM	CU	O2	HO2	97.7°	90.0°
NEM	CU	NEC	CDC	90.0°	90.0°
NEM	CU	NEC	CEB	84.4°	90.0°
CU	NEM	CDM	CG2	173.6°	90.0°
CU	NEM	CDM	CEL	173.6°	90.0°
CU	NEM	CDM	HD22	6.3°	90.0°
CU	NEM	CEL	NDL	173.6°	90.0°
CU	NEM	CEL	HE12	6.4°	90.0°
NEM	CU	NEW	CDW	93.3°	90.0°
NEM	CU	NEW	CEV	88.5°	90.0°
NEM	CU	NE6	CD6	16.6°	90.0°
NEM	CU	NE6	CE5	165.9°	90.0°
NEM	CU	O1	H15	21.1°	90.0°
NEM	CU	O2	H16	142.2°	90.0°
NEW	CU	O1	HO1	170.2°	90.0°
NEW	CU	O2	HO2	170.3°	90.0°
NEW	CU	NEC	CDC	153.2°	90.0°
NEW	CU	NEC	CEB	21.2°	90.0°
NEW	CU	NEM	CDM	55.1°	90.0°
NEW	CU	NEM	CEL	133.3°	90.0°
CU	NEW	CDW	CG3	178.5°	90.0°
CU	NEW	CDW	CEV	178.6°	90.0°
CU	NEW	CDW	HD23	1.5°	90.0°
CU	NEW	CEV	NDV	178.4°	90.0°
CU	NEW	CEV	HE13	1.7°	90.0°
NEW	CU	NE6	CD6	129.9°	90.0°
NEW	CU	NE6	CE5	47.6°	90.0°
NEW	CU	O1	H15	69.8°	90.0°
NEW	CU	O2	H16	50.3°	90.0°
NE6	CU	O1	HO1	71.6°	90.0°
NE6	CU	O2	HO2	71.8°	90.0°
NE6	CU	NEC	CDC	96.4°	90.0°
NE6	CU	NEC	CEB	89.2°	90.0°
NE6	CU	NEM	CDM	91.8°	90.0°
NE6	CU	NEM	CEL	79.7°	90.0°
NE6	CU	NEW	CDW	80.0°	90.0°
NE6	CU	NEW	CEV	98.1°	90.0°
CU	NE6	CD6	CG4	178.0°	90.0°
CU	NE6	CD6	CE5	177.9°	90.0°
CU	NE6	CD6	HD24	2.0°	90.0°
CU	NE6	CE5	ND5	178.6°	90.0°
CU	NE6	CE5	HE14	1.4°	90.0°
NE6	CU	O1	H15	168.4°	90.0°
NE6	CU	O2	H16	48.2°	90.0°
CDC	CG1	NDB	HG1	180.0°	90.0°
CG1	CDC	NEC	HD21	180.0°	90.0°
CDC	CG1	NDB	CEB	0.2°	90.0°
CG1	CDC	NEC	CEB	0.1°	90.0°
NDB	CG1	CDC	NEC	0.2°	90.0°
NDB	CG1	CDC	HD21	179.8°	90.0°
CG1	NDB	CEB	NEC	0.1°	90.0°
CG1	NDB	CEB	HE11	179.9°	90.0°
HG1	CG1	CDC	NEC	179.9°	90.0°
HG1	CG1	CDC	HD21	0.1°	90.0°
HG1	CG1	NDB	CEB	179.9°	90.0°
CDC	NEC	CEB	NDB	0.0°	90.0°
CDC	NEC	CEB	HE11	180.0°	90.0°
HD21	CDC	NEC	CEB	179.9°	90.0°
NDB	CEB	NEC	HE11	180.0°	90.0°
CDM	CG2	NDL	HG2	180.0°	90.0°
CG2	CDM	NEM	HD22	180.0°	90.0°
CDM	CG2	NDL	CEL	0.1°	90.0°
CG2	CDM	NEM	CEL	0.1°	90.0°
NDL	CG2	CDM	NEM	0.1°	90.0°
NDL	CG2	CDM	HD22	179.9°	90.0°
CG2	NDL	CEL	NEM	0.1°	90.0°
CG2	NDL	CEL	HE12	179.9°	90.0°
HG2	CG2	CDM	NEM	179.9°	90.0°
HG2	CG2	CDM	HD22	0.1°	90.0°
HG2	CG2	NDL	CEL	179.9°	90.0°
CDM	NEM	CEL	NDL	0.0°	90.0°
CDM	NEM	CEL	HE12	180.0°	90.0°
HD22	CDM	NEM	CEL	179.9°	90.0°
NDL	CEL	NEM	HE12	180.0°	90.0°
CDW	CG3	NDV	HG3	180.0°	90.0°
CG3	CDW	NEW	HD23	180.0°	90.0°
CDW	CG3	NDV	CEV	0.1°	90.0°
CG3	CDW	NEW	CEV	0.1°	90.0°
NDV	CG3	CDW	NEW	0.1°	90.0°
NDV	CG3	CDW	HD23	179.9°	90.0°
CG3	NDV	CEV	NEW	0.0°	90.0°
CG3	NDV	CEV	HE13	180.0°	90.0°
HG3	CG3	CDW	NEW	179.9°	90.0°
HG3	CG3	CDW	HD23	0.1°	90.0°
HG3	CG3	NDV	CEV	179.9°	90.0°
CDW	NEW	CEV	NDV	0.0°	90.0°
CDW	NEW	CEV	HE13	179.9°	90.0°
HD23	CDW	NEW	CEV	179.9°	90.0°
NDV	CEV	NEW	HE13	180.0°	90.0°
CD6	CG4	ND5	HG4	180.0°	90.0°
CG4	CD6	NE6	HD24	180.0°	90.0°
CD6	CG4	ND5	CE5	0.1°	90.0°
CG4	CD6	NE6	CE5	0.1°	90.0°
ND5	CG4	CD6	NE6	0.1°	90.0°
ND5	CG4	CD6	HD24	179.9°	90.0°
CG4	ND5	CE5	NE6	0.1°	90.0°
CG4	ND5	CE5	HE14	179.9°	90.0°
HG4	CG4	CD6	NE6	179.9°	90.0°
HG4	CG4	CD6	HD24	0.1°	90.0°
HG4	CG4	ND5	CE5	179.9°	90.0°
CD6	NE6	CE5	ND5	0.0°	90.0°
CD6	NE6	CE5	HE14	180.0°	90.0°
HD24	CD6	NE6	CE5	179.9°	90.0°
ND5	CE5	NE6	HE14	180.0°	90.0°

Definition date:	2001-10-03
Last modified:	2011-08-15
Release status:	REL
Processing site:	RCSB
Derived from:	1JZI