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Copper in PDB 6ju4: Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant

Enzymatic activity of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant

All present enzymatic activity of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant:
1.14.18.1;

Protein crystallography data

The structure of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant, PDB code: 6ju4 was solved by N.Fujieda, K.Umakoshi, Y.Nishikawa, G.Kurisu, S.Itoh, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 1.35
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 54.220, 118.143, 79.347, 90.00, 91.11, 90.00
R / Rfree (%) 15.7 / 20.1

Copper Binding Sites:

The binding sites of Copper atom in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant (pdb code 6ju4). This binding sites where shown within 5.0 Angstroms radius around Copper atom.
In total 8 binding sites of Copper where determined in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant, PDB code: 6ju4:
Jump to Copper binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Copper binding site 1 out of 8 in 6ju4

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Copper binding site 1 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 1 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu701

b:15.2
occ:0.59
CU A:CU701 0.0 15.2 0.6
CU A:CU701 1.8 20.9 0.2
NE2 A:HIS67 2.0 14.0 1.0
NE2 A:HIS103 2.1 11.4 1.0
NE2 A:HIS94 2.1 16.8 1.0
O A:HOH820 2.5 27.9 1.0
CD2 A:HIS67 2.9 13.5 1.0
CE1 A:HIS103 2.9 11.5 1.0
CE1 A:HIS94 3.0 16.3 1.0
CE1 A:HIS67 3.1 13.6 1.0
CD2 A:HIS94 3.1 17.5 1.0
CD2 A:HIS103 3.2 10.3 1.0
CB A:CYS92 3.5 15.1 1.0
SG A:CYS92 3.7 15.5 1.0
OE2 A:DAH513 3.7 23.9 0.8
CU A:CU702 3.8 11.8 0.5
CG A:HIS67 4.0 10.8 1.0
ND1 A:HIS103 4.1 10.2 1.0
ND1 A:HIS67 4.1 11.7 1.0
ND1 A:HIS94 4.1 15.3 1.0
CG A:HIS94 4.2 15.6 1.0
CG A:HIS103 4.3 9.0 1.0
NE2 A:HIS372 4.3 11.9 1.0
CZ A:PHE368 4.4 10.0 1.0
CU A:CU702 4.4 12.2 0.4
CE1 A:HIS372 4.5 11.1 1.0
CZ3 A:TRP102 4.5 10.6 1.0
CE2 A:PHE368 4.6 10.2 1.0
OH A:DAH513 4.6 16.5 0.2
OZ A:DAH513 4.7 17.6 0.8
O A:VAL93 4.8 14.3 1.0
CA A:CYS92 4.8 14.1 1.0
CE2 A:DAH513 4.9 16.4 0.2
CE2 A:DAH513 4.9 17.9 0.8
CE3 A:TRP102 5.0 9.7 1.0
CE1 A:PHE99 5.0 9.5 1.0

Copper binding site 2 out of 8 in 6ju4

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Copper binding site 2 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 2 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu701

b:20.9
occ:0.22
CU A:CU701 0.0 20.9 0.2
O A:HOH820 1.8 27.9 1.0
CU A:CU701 1.8 15.2 0.6
NE2 A:HIS94 2.1 16.8 1.0
OE2 A:DAH513 2.1 23.9 0.8
NE2 A:HIS67 2.3 14.0 1.0
CE1 A:HIS67 2.6 13.6 1.0
OH A:DAH513 2.9 16.5 0.2
CD2 A:HIS94 2.9 17.5 1.0
OZ A:DAH513 3.0 17.6 0.8
CE1 A:HIS94 3.1 16.3 1.0
CU A:CU702 3.2 11.8 0.5
CE2 A:DAH513 3.2 16.4 0.2
CE2 A:DAH513 3.3 17.9 0.8
CZ A:DAH513 3.5 16.3 0.2
CD2 A:HIS67 3.6 13.5 1.0
CZ A:DAH513 3.6 15.6 0.8
NE2 A:HIS103 3.7 11.4 1.0
ND1 A:HIS67 3.9 11.7 1.0
SG A:CYS92 3.9 15.5 1.0
CU A:CU702 3.9 12.2 0.4
CG A:HIS94 4.0 15.6 1.0
ND1 A:HIS94 4.1 15.3 1.0
CG1 A:VAL359 4.2 26.1 1.0
CE1 A:HIS103 4.4 11.5 1.0
CG A:HIS67 4.4 10.8 1.0
CD2 A:DAH513 4.4 15.7 0.2
CD2 A:DAH513 4.5 16.1 0.8
NE2 A:HIS328 4.5 10.8 1.0
CE2 A:PHE368 4.5 10.2 1.0
CB A:CYS92 4.5 15.1 1.0
NE2 A:HIS372 4.6 11.9 1.0
NE2 A:HIS332 4.6 12.7 1.0
CE1 A:HIS328 4.7 11.1 1.0
CD2 A:HIS103 4.8 10.3 1.0
CZ A:PHE368 4.8 10.0 1.0
CE1 A:DAH513 4.9 14.3 0.2
CE1 A:DAH513 5.0 14.4 0.8

Copper binding site 3 out of 8 in 6ju4

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Copper binding site 3 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 3 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu702

b:12.2
occ:0.44
CU A:CU702 0.0 12.2 0.4
CU A:CU702 1.0 11.8 0.5
NE2 A:HIS372 1.9 11.9 1.0
NE2 A:HIS332 1.9 12.7 1.0
O A:HOH820 2.3 27.9 1.0
NE2 A:HIS328 2.3 10.8 1.0
CD2 A:HIS372 2.7 13.0 1.0
CE1 A:HIS332 2.8 11.8 1.0
CE1 A:HIS372 3.0 11.1 1.0
CD2 A:HIS332 3.0 11.4 1.0
CD2 A:HIS328 3.0 9.6 1.0
CE1 A:HIS328 3.5 11.1 1.0
CE2 A:PHE368 3.6 10.2 1.0
OE2 A:DAH513 3.8 23.9 0.8
CG A:HIS372 3.9 9.5 1.0
ND1 A:HIS332 3.9 11.9 1.0
CU A:CU701 3.9 20.9 0.2
OZ A:DAH513 4.0 17.6 0.8
ND1 A:HIS372 4.0 10.3 1.0
CD2 A:HIS371 4.0 9.3 1.0
CG A:HIS332 4.1 10.1 1.0
CD2 A:PHE368 4.2 8.7 1.0
CG A:HIS328 4.3 9.8 1.0
CZ A:PHE368 4.3 10.0 1.0
OH A:DAH513 4.3 16.5 0.2
CE2 A:DAH513 4.4 17.9 0.8
CU A:CU701 4.4 15.2 0.6
CZ A:DAH513 4.4 15.6 0.8
NE2 A:HIS371 4.4 10.3 1.0
ND1 A:HIS328 4.4 11.7 1.0
CZ A:DAH513 4.7 16.3 0.2
CE2 A:DAH513 4.7 16.4 0.2
NE2 A:HIS103 4.9 11.4 1.0
NE2 A:HIS67 5.0 14.0 1.0

Copper binding site 4 out of 8 in 6ju4

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Copper binding site 4 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 4 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu702

b:11.8
occ:0.45
CU A:CU702 0.0 11.8 0.5
CU A:CU702 1.0 12.2 0.4
O A:HOH820 1.7 27.9 1.0
NE2 A:HIS328 1.8 10.8 1.0
NE2 A:HIS372 2.2 11.9 1.0
NE2 A:HIS332 2.3 12.7 1.0
CE1 A:HIS328 2.8 11.1 1.0
CD2 A:HIS328 2.9 9.6 1.0
OE2 A:DAH513 2.9 23.9 0.8
CE1 A:HIS372 3.0 11.1 1.0
CD2 A:HIS332 3.2 11.4 1.0
CU A:CU701 3.2 20.9 0.2
CE1 A:HIS332 3.3 11.8 1.0
CD2 A:HIS372 3.4 13.0 1.0
CE2 A:DAH513 3.7 17.9 0.8
OZ A:DAH513 3.7 17.6 0.8
CU A:CU701 3.8 15.2 0.6
ND1 A:HIS328 3.9 11.7 1.0
OH A:DAH513 4.0 16.5 0.2
CG A:HIS328 4.0 9.8 1.0
CZ A:DAH513 4.0 15.6 0.8
CE2 A:DAH513 4.0 16.4 0.2
CE2 A:PHE368 4.1 10.2 1.0
CZ A:DAH513 4.2 16.3 0.2
ND1 A:HIS372 4.2 10.3 1.0
CG A:HIS332 4.3 10.1 1.0
ND1 A:HIS332 4.3 11.9 1.0
NE2 A:HIS103 4.4 11.4 1.0
CG A:HIS372 4.4 9.5 1.0
CE1 A:PHE99 4.6 9.5 1.0
NE2 A:HIS67 4.6 14.0 1.0
CD2 A:DAH513 4.6 16.1 0.8
CZ A:PHE368 4.7 10.0 1.0
NE2 A:HIS94 4.8 16.8 1.0
CD2 A:HIS103 4.8 10.3 1.0
CD2 A:DAH513 4.9 15.7 0.2
CD2 A:HIS371 4.9 9.3 1.0
CD2 A:PHE368 4.9 8.7 1.0
CZ A:PHE99 4.9 10.5 1.0
CD2 A:HIS94 4.9 17.5 1.0
CE1 A:HIS67 5.0 13.6 1.0

Copper binding site 5 out of 8 in 6ju4

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Copper binding site 5 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 5 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu701

b:17.1
occ:0.65
CU B:CU701 0.0 17.1 0.7
CU B:CU701 1.9 16.0 0.2
NE2 B:HIS67 2.0 14.5 1.0
NE2 B:HIS103 2.1 11.9 1.0
NE2 B:HIS94 2.1 14.9 1.0
O B:HOH846 2.4 24.8 1.0
CD2 B:HIS67 2.9 13.7 1.0
CE1 B:HIS103 2.9 11.6 1.0
CE1 B:HIS67 3.1 12.9 1.0
CE1 B:HIS94 3.1 14.8 1.0
CD2 B:HIS94 3.2 15.6 1.0
CD2 B:HIS103 3.2 11.0 1.0
CB B:CYS92 3.6 13.9 1.0
CU B:CU702 3.7 12.7 0.5
SG B:CYS92 3.7 14.5 1.0
OE2 B:DAH513 3.8 17.5 0.6
CG B:HIS67 4.0 10.6 1.0
ND1 B:HIS103 4.1 10.8 1.0
ND1 B:HIS67 4.1 11.8 1.0
ND1 B:HIS94 4.2 13.5 1.0
CG B:HIS103 4.3 10.2 1.0
CG B:HIS94 4.3 14.7 1.0
NE2 B:HIS372 4.3 12.8 1.0
CU B:CU702 4.3 13.6 0.4
CZ B:PHE368 4.4 11.6 1.0
CE1 B:HIS372 4.5 12.1 1.0
CE2 B:PHE368 4.5 10.3 1.0
CZ3 B:TRP102 4.6 9.0 1.0
OH B:DAH513 4.6 17.1 0.4
OZ B:DAH513 4.6 16.4 0.6
O B:VAL93 4.8 13.6 1.0
CE1 B:PHE99 4.9 9.6 1.0
CA B:CYS92 4.9 10.9 1.0
NE2 B:HIS328 4.9 11.6 1.0
CE2 B:DAH513 4.9 17.0 0.4
CE2 B:DAH513 5.0 16.7 0.6

Copper binding site 6 out of 8 in 6ju4

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Copper binding site 6 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 6 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu701

b:16.0
occ:0.17
CU B:CU701 0.0 16.0 0.2
O B:HOH846 1.7 24.8 1.0
CU B:CU701 1.9 17.1 0.7
NE2 B:HIS94 2.2 14.9 1.0
NE2 B:HIS67 2.3 14.5 1.0
OE2 B:DAH513 2.3 17.5 0.6
CE1 B:HIS67 2.5 12.9 1.0
OH B:DAH513 2.9 17.1 0.4
OZ B:DAH513 3.0 16.4 0.6
CD2 B:HIS94 3.0 15.6 1.0
CE1 B:HIS94 3.1 14.8 1.0
CU B:CU702 3.2 12.7 0.5
CE2 B:DAH513 3.2 17.0 0.4
CE2 B:DAH513 3.3 16.7 0.6
CZ B:DAH513 3.5 14.8 0.4
CZ B:DAH513 3.6 13.5 0.6
CD2 B:HIS67 3.6 13.7 1.0
ND1 B:HIS67 3.8 11.8 1.0
NE2 B:HIS103 3.8 11.9 1.0
SG B:CYS92 3.9 14.5 1.0
CU B:CU702 4.0 13.6 0.4
CG B:HIS94 4.0 14.7 1.0
ND1 B:HIS94 4.1 13.5 1.0
CG2 B:VAL359 4.1 27.5 1.0
CG1 B:VAL359 4.2 28.2 1.0
CG B:HIS67 4.3 10.6 1.0
CE2 B:PHE368 4.5 10.3 1.0
CE1 B:HIS103 4.5 11.6 1.0
CD2 B:DAH513 4.5 15.8 0.4
CD2 B:DAH513 4.5 15.4 0.6
NE2 B:HIS328 4.6 11.6 1.0
CB B:CYS92 4.6 13.9 1.0
NE2 B:HIS332 4.7 11.4 1.0
CB B:VAL359 4.7 21.2 1.0
NE2 B:HIS372 4.7 12.8 1.0
CE1 B:HIS328 4.7 11.5 1.0
CZ B:PHE368 4.9 11.6 1.0
CD2 B:HIS103 4.9 11.0 1.0
CE1 B:DAH513 4.9 14.2 0.4
CE1 B:HIS332 4.9 13.0 1.0
CE1 B:DAH513 4.9 15.5 0.6

Copper binding site 7 out of 8 in 6ju4

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Copper binding site 7 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 7 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu702

b:13.6
occ:0.43
CU B:CU702 0.0 13.6 0.4
CU B:CU702 1.1 12.7 0.5
NE2 B:HIS332 1.8 11.4 1.0
NE2 B:HIS372 1.9 12.8 1.0
O B:HOH846 2.3 24.8 1.0
NE2 B:HIS328 2.3 11.6 1.0
CE1 B:HIS332 2.7 13.0 1.0
CD2 B:HIS372 2.7 13.0 1.0
CE1 B:HIS372 2.9 12.1 1.0
CD2 B:HIS332 3.0 11.7 1.0
CD2 B:HIS328 3.0 10.7 1.0
CE1 B:HIS328 3.5 11.5 1.0
CE2 B:PHE368 3.7 10.3 1.0
OE2 B:DAH513 3.9 17.5 0.6
ND1 B:HIS332 3.9 11.7 1.0
CG B:HIS372 3.9 10.6 1.0
OZ B:DAH513 3.9 16.4 0.6
ND1 B:HIS372 3.9 11.3 1.0
CU B:CU701 4.0 16.0 0.2
CG B:HIS332 4.0 9.0 1.0
CD2 B:HIS371 4.1 12.1 1.0
CD2 B:PHE368 4.2 9.2 1.0
OH B:DAH513 4.3 17.1 0.4
CG B:HIS328 4.3 10.5 1.0
CU B:CU701 4.3 17.1 0.7
CZ B:PHE368 4.4 11.6 1.0
CE2 B:DAH513 4.4 16.7 0.6
CZ B:DAH513 4.4 13.5 0.6
ND1 B:HIS328 4.4 11.5 1.0
NE2 B:HIS371 4.5 9.8 1.0
CZ B:DAH513 4.6 14.8 0.4
CE2 B:DAH513 4.6 17.0 0.4
NE2 B:HIS103 4.9 11.9 1.0
NE2 B:HIS67 5.0 14.5 1.0

Copper binding site 8 out of 8 in 6ju4

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Copper binding site 8 out of 8 in the Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 8 of Aspergillus Oryzae Pro-Tyrosinase F513Y Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu702

b:12.7
occ:0.47
CU B:CU702 0.0 12.7 0.5
CU B:CU702 1.1 13.6 0.4
O B:HOH846 1.7 24.8 1.0
NE2 B:HIS328 1.8 11.6 1.0
NE2 B:HIS332 2.3 11.4 1.0
NE2 B:HIS372 2.3 12.8 1.0
CE1 B:HIS328 2.7 11.5 1.0
CD2 B:HIS328 2.9 10.7 1.0
OE2 B:DAH513 3.0 17.5 0.6
CE1 B:HIS372 3.0 12.1 1.0
CD2 B:HIS332 3.2 11.7 1.0
CU B:CU701 3.2 16.0 0.2
CE1 B:HIS332 3.2 13.0 1.0
CD2 B:HIS372 3.5 13.0 1.0
OZ B:DAH513 3.6 16.4 0.6
CE2 B:DAH513 3.7 16.7 0.6
CU B:CU701 3.7 17.1 0.7
ND1 B:HIS328 3.9 11.5 1.0
CE2 B:DAH513 3.9 17.0 0.4
OH B:DAH513 3.9 17.1 0.4
CZ B:DAH513 3.9 13.5 0.6
CG B:HIS328 4.0 10.5 1.0
CZ B:DAH513 4.2 14.8 0.4
CE2 B:PHE368 4.2 10.3 1.0
ND1 B:HIS372 4.3 11.3 1.0
ND1 B:HIS332 4.3 11.7 1.0
CG B:HIS332 4.3 9.0 1.0
NE2 B:HIS103 4.4 11.9 1.0
CG B:HIS372 4.5 10.6 1.0
CE1 B:PHE99 4.5 9.6 1.0
NE2 B:HIS67 4.6 14.5 1.0
CD2 B:DAH513 4.7 15.4 0.6
NE2 B:HIS94 4.7 14.9 1.0
CZ B:PHE368 4.8 11.6 1.0
CD2 B:DAH513 4.8 15.8 0.4
CD2 B:HIS103 4.8 11.0 1.0
CD2 B:HIS94 4.8 15.6 1.0
CZ B:PHE99 4.9 9.5 1.0
CD2 B:PHE368 4.9 9.2 1.0
CD2 B:HIS371 5.0 12.1 1.0

Reference:

N.Fujieda, K.Umakoshi, Y.Ochi, Y.Nishikawa, S.Yanagisawa, M.Kubo, G.Kurisu, S.Itoh. Copper-Oxygen Dynamics in Tyrosinase Mechanism. Angew.Chem.Int.Ed.Engl. 2020.
ISSN: ESSN 1521-3773
PubMed: 32356371
DOI: 10.1002/ANIE.202004733
Page generated: Mon Jul 14 06:18:44 2025

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