5K09
Crystal Structure of COMT in complex with a thiazole ligand
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0000287 | molecular_function | magnesium ion binding |
A | 0006584 | biological_process | catecholamine metabolic process |
A | 0008171 | molecular_function | O-methyltransferase activity |
A | 0016206 | molecular_function | catechol O-methyltransferase activity |
B | 0000287 | molecular_function | magnesium ion binding |
B | 0006584 | biological_process | catecholamine metabolic process |
B | 0008171 | molecular_function | O-methyltransferase activity |
B | 0016206 | molecular_function | catechol O-methyltransferase activity |
C | 0000287 | molecular_function | magnesium ion binding |
C | 0006584 | biological_process | catecholamine metabolic process |
C | 0008171 | molecular_function | O-methyltransferase activity |
C | 0016206 | molecular_function | catechol O-methyltransferase activity |
D | 0000287 | molecular_function | magnesium ion binding |
D | 0006584 | biological_process | catecholamine metabolic process |
D | 0008171 | molecular_function | O-methyltransferase activity |
D | 0016206 | molecular_function | catechol O-methyltransferase activity |
E | 0000287 | molecular_function | magnesium ion binding |
E | 0006584 | biological_process | catecholamine metabolic process |
E | 0008171 | molecular_function | O-methyltransferase activity |
E | 0016206 | molecular_function | catechol O-methyltransferase activity |
F | 0000287 | molecular_function | magnesium ion binding |
F | 0006584 | biological_process | catecholamine metabolic process |
F | 0008171 | molecular_function | O-methyltransferase activity |
F | 0016206 | molecular_function | catechol O-methyltransferase activity |
G | 0000287 | molecular_function | magnesium ion binding |
G | 0006584 | biological_process | catecholamine metabolic process |
G | 0008171 | molecular_function | O-methyltransferase activity |
G | 0016206 | molecular_function | catechol O-methyltransferase activity |
H | 0000287 | molecular_function | magnesium ion binding |
H | 0006584 | biological_process | catecholamine metabolic process |
H | 0008171 | molecular_function | O-methyltransferase activity |
H | 0016206 | molecular_function | catechol O-methyltransferase activity |
I | 0000287 | molecular_function | magnesium ion binding |
I | 0006584 | biological_process | catecholamine metabolic process |
I | 0008171 | molecular_function | O-methyltransferase activity |
I | 0016206 | molecular_function | catechol O-methyltransferase activity |
J | 0000287 | molecular_function | magnesium ion binding |
J | 0006584 | biological_process | catecholamine metabolic process |
J | 0008171 | molecular_function | O-methyltransferase activity |
J | 0016206 | molecular_function | catechol O-methyltransferase activity |
K | 0000287 | molecular_function | magnesium ion binding |
K | 0006584 | biological_process | catecholamine metabolic process |
K | 0008171 | molecular_function | O-methyltransferase activity |
K | 0016206 | molecular_function | catechol O-methyltransferase activity |
L | 0000287 | molecular_function | magnesium ion binding |
L | 0006584 | biological_process | catecholamine metabolic process |
L | 0008171 | molecular_function | O-methyltransferase activity |
L | 0016206 | molecular_function | catechol O-methyltransferase activity |
M | 0000287 | molecular_function | magnesium ion binding |
M | 0006584 | biological_process | catecholamine metabolic process |
M | 0008171 | molecular_function | O-methyltransferase activity |
M | 0016206 | molecular_function | catechol O-methyltransferase activity |
N | 0000287 | molecular_function | magnesium ion binding |
N | 0006584 | biological_process | catecholamine metabolic process |
N | 0008171 | molecular_function | O-methyltransferase activity |
N | 0016206 | molecular_function | catechol O-methyltransferase activity |
O | 0000287 | molecular_function | magnesium ion binding |
O | 0006584 | biological_process | catecholamine metabolic process |
O | 0008171 | molecular_function | O-methyltransferase activity |
O | 0016206 | molecular_function | catechol O-methyltransferase activity |
P | 0000287 | molecular_function | magnesium ion binding |
P | 0006584 | biological_process | catecholamine metabolic process |
P | 0008171 | molecular_function | O-methyltransferase activity |
P | 0016206 | molecular_function | catechol O-methyltransferase activity |
Q | 0000287 | molecular_function | magnesium ion binding |
Q | 0006584 | biological_process | catecholamine metabolic process |
Q | 0008171 | molecular_function | O-methyltransferase activity |
Q | 0016206 | molecular_function | catechol O-methyltransferase activity |
R | 0000287 | molecular_function | magnesium ion binding |
R | 0006584 | biological_process | catecholamine metabolic process |
R | 0008171 | molecular_function | O-methyltransferase activity |
R | 0016206 | molecular_function | catechol O-methyltransferase activity |
S | 0000287 | molecular_function | magnesium ion binding |
S | 0006584 | biological_process | catecholamine metabolic process |
S | 0008171 | molecular_function | O-methyltransferase activity |
S | 0016206 | molecular_function | catechol O-methyltransferase activity |
T | 0000287 | molecular_function | magnesium ion binding |
T | 0006584 | biological_process | catecholamine metabolic process |
T | 0008171 | molecular_function | O-methyltransferase activity |
T | 0016206 | molecular_function | catechol O-methyltransferase activity |
U | 0000287 | molecular_function | magnesium ion binding |
U | 0006584 | biological_process | catecholamine metabolic process |
U | 0008171 | molecular_function | O-methyltransferase activity |
U | 0016206 | molecular_function | catechol O-methyltransferase activity |
V | 0000287 | molecular_function | magnesium ion binding |
V | 0006584 | biological_process | catecholamine metabolic process |
V | 0008171 | molecular_function | O-methyltransferase activity |
V | 0016206 | molecular_function | catechol O-methyltransferase activity |
W | 0000287 | molecular_function | magnesium ion binding |
W | 0006584 | biological_process | catecholamine metabolic process |
W | 0008171 | molecular_function | O-methyltransferase activity |
W | 0016206 | molecular_function | catechol O-methyltransferase activity |
X | 0000287 | molecular_function | magnesium ion binding |
X | 0006584 | biological_process | catecholamine metabolic process |
X | 0008171 | molecular_function | O-methyltransferase activity |
X | 0016206 | molecular_function | catechol O-methyltransferase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 9 |
Details | binding site for residue 6PQ A 301 |
Chain | Residue |
A | MET89 |
A | GLU90 |
A | ILE91 |
A | GLY117 |
A | SER119 |
A | GLN120 |
A | HIS142 |
A | TRP143 |
D | MET201 |
site_id | AC2 |
Number of Residues | 6 |
Details | binding site for residue K A 302 |
Chain | Residue |
A | ASN41 |
A | ASP141 |
A | ASP169 |
A | ASN170 |
D | GLU199 |
D | HOH416 |
site_id | AC3 |
Number of Residues | 5 |
Details | binding site for residue K A 303 |
Chain | Residue |
A | VAL183 |
A | ARG184 |
A | SER186 |
A | PHE189 |
A | HOH421 |
site_id | AC4 |
Number of Residues | 2 |
Details | binding site for residue K A 304 |
Chain | Residue |
A | SER58 |
A | SER60 |
site_id | AC5 |
Number of Residues | 9 |
Details | binding site for residue 6PQ B 301 |
Chain | Residue |
B | GLY66 |
B | MET89 |
B | GLU90 |
B | ILE91 |
B | SER119 |
B | GLN120 |
B | HIS142 |
B | TRP143 |
Q | MET201 |
site_id | AC6 |
Number of Residues | 6 |
Details | binding site for residue K B 302 |
Chain | Residue |
B | ASN41 |
B | ASP141 |
B | ASP169 |
B | ASN170 |
Q | GLU199 |
Q | HOH422 |
site_id | AC7 |
Number of Residues | 4 |
Details | binding site for residue K B 303 |
Chain | Residue |
B | VAL183 |
B | ARG184 |
B | SER186 |
B | PHE189 |
site_id | AC8 |
Number of Residues | 9 |
Details | binding site for residue 6PQ C 301 |
Chain | Residue |
C | GLU90 |
C | ILE91 |
C | GLY117 |
C | ALA118 |
C | SER119 |
C | GLN120 |
C | HIS142 |
C | TRP143 |
G | LYS202 |
site_id | AC9 |
Number of Residues | 6 |
Details | binding site for residue K C 302 |
Chain | Residue |
C | ASN41 |
C | ASP141 |
C | ASP169 |
C | ASN170 |
G | GLU199 |
G | HOH408 |
site_id | AD1 |
Number of Residues | 5 |
Details | binding site for residue K C 303 |
Chain | Residue |
C | VAL183 |
C | ARG184 |
C | SER186 |
C | PHE189 |
C | HOH419 |
site_id | AD2 |
Number of Residues | 3 |
Details | binding site for residue PO4 C 304 |
Chain | Residue |
C | GLY83 |
C | ARG85 |
C | LYS111 |
site_id | AD3 |
Number of Residues | 10 |
Details | binding site for residue 6PQ D 301 |
Chain | Residue |
A | MET201 |
D | MET89 |
D | GLU90 |
D | ILE91 |
D | ALA118 |
D | SER119 |
D | GLN120 |
D | HIS142 |
D | TRP143 |
E | ASP178 |
site_id | AD4 |
Number of Residues | 6 |
Details | binding site for residue K D 302 |
Chain | Residue |
A | GLU199 |
A | HOH416 |
D | ASN41 |
D | ASP141 |
D | ASP169 |
D | ASN170 |
site_id | AD5 |
Number of Residues | 5 |
Details | binding site for residue K D 303 |
Chain | Residue |
D | VAL183 |
D | ARG184 |
D | SER186 |
D | PHE189 |
D | HOH417 |
site_id | AD6 |
Number of Residues | 4 |
Details | binding site for residue PO4 D 304 |
Chain | Residue |
D | PRO82 |
D | GLY83 |
D | ARG85 |
D | LYS111 |
site_id | AD7 |
Number of Residues | 12 |
Details | binding site for residue 6PQ E 301 |
Chain | Residue |
G | ASP178 |
W | MET201 |
E | GLY66 |
E | MET89 |
E | GLU90 |
E | ILE91 |
E | GLY117 |
E | SER119 |
E | GLN120 |
E | HIS142 |
E | TRP143 |
E | ARG146 |
site_id | AD8 |
Number of Residues | 5 |
Details | binding site for residue K E 302 |
Chain | Residue |
E | ASN41 |
E | ASP141 |
E | ASP169 |
E | ASN170 |
W | GLU199 |
site_id | AD9 |
Number of Residues | 5 |
Details | binding site for residue K E 303 |
Chain | Residue |
E | VAL183 |
E | ARG184 |
E | SER186 |
E | PHE189 |
E | HOH413 |
site_id | AE1 |
Number of Residues | 11 |
Details | binding site for residue 6PQ F 301 |
Chain | Residue |
F | MET89 |
F | GLU90 |
F | ILE91 |
F | ALA118 |
F | SER119 |
F | GLN120 |
F | HIS142 |
F | TRP143 |
I | MET201 |
T | LEU148 |
T | ASP178 |
site_id | AE2 |
Number of Residues | 6 |
Details | binding site for residue K F 302 |
Chain | Residue |
F | ASN41 |
F | ASP141 |
F | ASP169 |
F | ASN170 |
F | HOH421 |
I | GLU199 |
site_id | AE3 |
Number of Residues | 5 |
Details | binding site for residue K F 303 |
Chain | Residue |
F | VAL183 |
F | ARG184 |
F | SER186 |
F | PHE189 |
F | HOH417 |
site_id | AE4 |
Number of Residues | 14 |
Details | binding site for residue 6PQ G 301 |
Chain | Residue |
C | MET201 |
D | LEU148 |
D | ASP178 |
D | TYR182 |
G | GLY66 |
G | MET89 |
G | GLU90 |
G | ILE91 |
G | GLY117 |
G | ALA118 |
G | SER119 |
G | GLN120 |
G | HIS142 |
G | TRP143 |
site_id | AE5 |
Number of Residues | 2 |
Details | binding site for residue K G 302 |
Chain | Residue |
G | SER58 |
G | SER60 |
site_id | AE6 |
Number of Residues | 5 |
Details | binding site for residue K G 303 |
Chain | Residue |
G | VAL183 |
G | ARG184 |
G | SER186 |
G | PHE189 |
G | HOH411 |
site_id | AE7 |
Number of Residues | 6 |
Details | binding site for residue K G 304 |
Chain | Residue |
C | GLU199 |
G | ASN41 |
G | ASP141 |
G | ASP169 |
G | ASN170 |
G | HOH413 |
site_id | AE8 |
Number of Residues | 9 |
Details | binding site for residue 6PQ H 301 |
Chain | Residue |
H | MET89 |
H | GLU90 |
H | ILE91 |
H | SER119 |
H | GLN120 |
H | HIS142 |
H | TRP143 |
K | ASP178 |
R | MET201 |
site_id | AE9 |
Number of Residues | 6 |
Details | binding site for residue K H 302 |
Chain | Residue |
H | ASN41 |
H | ASP141 |
H | ASP169 |
H | ASN170 |
R | GLU199 |
R | HOH412 |
site_id | AF1 |
Number of Residues | 5 |
Details | binding site for residue K H 303 |
Chain | Residue |
H | VAL183 |
H | ARG184 |
H | SER186 |
H | PHE189 |
H | HOH429 |
site_id | AF2 |
Number of Residues | 5 |
Details | binding site for residue PO4 H 304 |
Chain | Residue |
H | PRO82 |
H | GLY83 |
H | ARG85 |
H | LYS111 |
H | HOH408 |
site_id | AF3 |
Number of Residues | 9 |
Details | binding site for residue 6PQ I 301 |
Chain | Residue |
I | GLY66 |
I | MET89 |
I | GLU90 |
I | ILE91 |
I | SER119 |
I | GLN120 |
I | HIS142 |
I | TRP143 |
X | ALA181 |
site_id | AF4 |
Number of Residues | 6 |
Details | binding site for residue K I 302 |
Chain | Residue |
F | GLU199 |
I | ASN41 |
I | ASP141 |
I | ASP169 |
I | ASN170 |
I | HOH418 |
site_id | AF5 |
Number of Residues | 5 |
Details | binding site for residue K I 303 |
Chain | Residue |
I | VAL183 |
I | ARG184 |
I | SER186 |
I | PHE189 |
I | HOH420 |
site_id | AF6 |
Number of Residues | 4 |
Details | binding site for residue PO4 I 304 |
Chain | Residue |
I | PRO82 |
I | GLY83 |
I | ARG85 |
I | LYS111 |
site_id | AF7 |
Number of Residues | 12 |
Details | binding site for residue 6PQ J 301 |
Chain | Residue |
J | GLY66 |
J | MET89 |
J | GLU90 |
J | ILE91 |
J | GLY117 |
J | SER119 |
J | GLN120 |
J | HIS142 |
J | TRP143 |
J | ARG146 |
M | ASP178 |
O | MET201 |
site_id | AF8 |
Number of Residues | 6 |
Details | binding site for residue K J 302 |
Chain | Residue |
J | ASN41 |
J | ASP141 |
J | ASP169 |
J | ASN170 |
J | HOH419 |
O | GLU199 |
site_id | AF9 |
Number of Residues | 4 |
Details | binding site for residue K J 303 |
Chain | Residue |
J | VAL183 |
J | ARG184 |
J | SER186 |
J | PHE189 |
site_id | AG1 |
Number of Residues | 2 |
Details | binding site for residue K J 304 |
Chain | Residue |
J | SER58 |
J | SER60 |
site_id | AG2 |
Number of Residues | 12 |
Details | binding site for residue 6PQ K 301 |
Chain | Residue |
B | ASP178 |
B | TYR182 |
K | GLY66 |
K | MET89 |
K | GLU90 |
K | ILE91 |
K | GLY117 |
K | ALA118 |
K | SER119 |
K | GLN120 |
K | TRP143 |
N | MET201 |
site_id | AG3 |
Number of Residues | 6 |
Details | binding site for residue K K 302 |
Chain | Residue |
K | ASN41 |
K | ASP141 |
K | ASP169 |
K | ASN170 |
N | GLU199 |
N | HOH431 |
site_id | AG4 |
Number of Residues | 4 |
Details | binding site for residue K K 303 |
Chain | Residue |
K | VAL183 |
K | ARG184 |
K | SER186 |
K | PHE189 |
site_id | AG5 |
Number of Residues | 2 |
Details | binding site for residue K K 304 |
Chain | Residue |
K | SER58 |
K | SER60 |
site_id | AG6 |
Number of Residues | 4 |
Details | binding site for residue PO4 K 305 |
Chain | Residue |
K | PRO82 |
K | GLY83 |
K | ARG85 |
K | LYS111 |
site_id | AG7 |
Number of Residues | 11 |
Details | binding site for residue 6PQ L 301 |
Chain | Residue |
L | GLY66 |
L | MET89 |
L | GLU90 |
L | ILE91 |
L | GLY117 |
L | SER119 |
L | GLN120 |
L | HIS142 |
L | TRP143 |
M | MET201 |
O | ASP178 |
site_id | AG8 |
Number of Residues | 6 |
Details | binding site for residue K L 302 |
Chain | Residue |
L | ASN41 |
L | ASP141 |
L | ASP169 |
L | ASN170 |
M | GLU199 |
M | HOH412 |
site_id | AG9 |
Number of Residues | 3 |
Details | binding site for residue K L 303 |
Chain | Residue |
L | SER58 |
L | SER60 |
L | GLN81 |
site_id | AH1 |
Number of Residues | 5 |
Details | binding site for residue K L 304 |
Chain | Residue |
L | VAL183 |
L | ARG184 |
L | SER186 |
L | PHE189 |
L | HOH420 |
site_id | AH2 |
Number of Residues | 9 |
Details | binding site for residue 6PQ M 301 |
Chain | Residue |
L | MET201 |
M | GLY66 |
M | GLU90 |
M | ILE91 |
M | ALA118 |
M | SER119 |
M | GLN120 |
M | TRP143 |
V | ASP178 |
site_id | AH3 |
Number of Residues | 6 |
Details | binding site for residue K M 302 |
Chain | Residue |
L | GLU199 |
L | HOH404 |
M | ASN41 |
M | ASP141 |
M | ASP169 |
M | ASN170 |
site_id | AH4 |
Number of Residues | 5 |
Details | binding site for residue K M 303 |
Chain | Residue |
M | VAL183 |
M | ARG184 |
M | SER186 |
M | PHE189 |
M | HOH419 |
site_id | AH5 |
Number of Residues | 2 |
Details | binding site for residue K M 304 |
Chain | Residue |
M | SER58 |
M | SER60 |
site_id | AH6 |
Number of Residues | 4 |
Details | binding site for residue PO4 M 305 |
Chain | Residue |
M | PRO82 |
M | GLY83 |
M | ARG85 |
M | LYS111 |
site_id | AH7 |
Number of Residues | 10 |
Details | binding site for residue 6PQ N 301 |
Chain | Residue |
K | MET201 |
N | GLU90 |
N | ILE91 |
N | GLY117 |
N | SER119 |
N | GLN120 |
N | HIS142 |
N | TRP143 |
N | ARG146 |
R | LEU148 |
site_id | AH8 |
Number of Residues | 6 |
Details | binding site for residue K N 302 |
Chain | Residue |
K | GLU199 |
N | ASN41 |
N | ASP141 |
N | ASP169 |
N | ASN170 |
N | HOH425 |
site_id | AH9 |
Number of Residues | 4 |
Details | binding site for residue K N 303 |
Chain | Residue |
N | VAL183 |
N | ARG184 |
N | SER186 |
N | PHE189 |
site_id | AI1 |
Number of Residues | 4 |
Details | binding site for residue K N 304 |
Chain | Residue |
N | SER58 |
N | SER60 |
N | HOH432 |
N | HOH440 |
site_id | AI2 |
Number of Residues | 6 |
Details | binding site for residue PO4 N 305 |
Chain | Residue |
N | PRO82 |
N | GLY83 |
N | ARG85 |
N | LYS111 |
O | SER60 |
O | HOH403 |
site_id | AI3 |
Number of Residues | 11 |
Details | binding site for residue 6PQ O 301 |
Chain | Residue |
J | MET201 |
O | GLY66 |
O | MET89 |
O | GLU90 |
O | ILE91 |
O | ALA118 |
O | SER119 |
O | GLN120 |
O | HIS142 |
O | TRP143 |
U | ASP178 |
site_id | AI4 |
Number of Residues | 6 |
Details | binding site for residue K O 302 |
Chain | Residue |
J | GLU199 |
O | ASN41 |
O | ASP141 |
O | ASP169 |
O | ASN170 |
O | HOH421 |
site_id | AI5 |
Number of Residues | 5 |
Details | binding site for residue K O 303 |
Chain | Residue |
O | VAL183 |
O | ARG184 |
O | SER186 |
O | PHE189 |
O | HOH422 |
site_id | AI6 |
Number of Residues | 4 |
Details | binding site for residue K O 304 |
Chain | Residue |
N | HOH439 |
O | SER58 |
O | SER60 |
O | HOH405 |
site_id | AI7 |
Number of Residues | 11 |
Details | binding site for residue 6PQ P 301 |
Chain | Residue |
F | LEU148 |
P | MET89 |
P | GLU90 |
P | ILE91 |
P | GLY117 |
P | ALA118 |
P | SER119 |
P | GLN120 |
P | HIS142 |
P | TRP143 |
X | MET201 |
site_id | AI8 |
Number of Residues | 6 |
Details | binding site for residue K P 302 |
Chain | Residue |
P | ASN41 |
P | ASP141 |
P | ASP169 |
P | ASN170 |
P | HOH406 |
X | GLU199 |
site_id | AI9 |
Number of Residues | 4 |
Details | binding site for residue K P 303 |
Chain | Residue |
P | VAL183 |
P | ARG184 |
P | SER186 |
P | PHE189 |
site_id | AJ1 |
Number of Residues | 10 |
Details | binding site for residue 6PQ Q 301 |
Chain | Residue |
B | MET201 |
N | ASP178 |
Q | GLY66 |
Q | MET89 |
Q | GLU90 |
Q | ILE91 |
Q | SER119 |
Q | GLN120 |
Q | HIS142 |
Q | TRP143 |
site_id | AJ2 |
Number of Residues | 6 |
Details | binding site for residue K Q 302 |
Chain | Residue |
B | GLU199 |
B | HOH416 |
Q | ASN41 |
Q | ASP141 |
Q | ASP169 |
Q | ASN170 |
site_id | AJ3 |
Number of Residues | 5 |
Details | binding site for residue K Q 303 |
Chain | Residue |
Q | VAL183 |
Q | ARG184 |
Q | SER186 |
Q | PHE189 |
Q | HOH423 |
site_id | AJ4 |
Number of Residues | 3 |
Details | binding site for residue PO4 Q 304 |
Chain | Residue |
Q | GLY83 |
Q | ARG85 |
Q | LYS111 |
site_id | AJ5 |
Number of Residues | 12 |
Details | binding site for residue 6PQ R 301 |
Chain | Residue |
H | MET201 |
Q | ASP178 |
Q | TYR182 |
R | GLY66 |
R | MET89 |
R | GLU90 |
R | ILE91 |
R | ALA118 |
R | SER119 |
R | GLN120 |
R | HIS142 |
R | TRP143 |
site_id | AJ6 |
Number of Residues | 6 |
Details | binding site for residue K R 302 |
Chain | Residue |
H | GLU199 |
H | HOH414 |
R | ASN41 |
R | ASP141 |
R | ASP169 |
R | ASN170 |
site_id | AJ7 |
Number of Residues | 3 |
Details | binding site for residue K R 303 |
Chain | Residue |
R | SER58 |
R | SER60 |
R | GLN81 |
site_id | AJ8 |
Number of Residues | 5 |
Details | binding site for residue K R 304 |
Chain | Residue |
R | VAL183 |
R | ARG184 |
R | SER186 |
R | PHE189 |
R | HOH421 |
site_id | AJ9 |
Number of Residues | 10 |
Details | binding site for residue 6PQ S 301 |
Chain | Residue |
S | GLY66 |
S | GLU90 |
S | ILE91 |
S | GLY117 |
S | ALA118 |
S | SER119 |
S | GLN120 |
S | HIS142 |
S | TRP143 |
T | MET201 |
site_id | AK1 |
Number of Residues | 6 |
Details | binding site for residue K S 302 |
Chain | Residue |
S | ASN41 |
S | ASP141 |
S | ASP169 |
S | ASN170 |
S | HOH418 |
T | GLU199 |
site_id | AK2 |
Number of Residues | 2 |
Details | binding site for residue K S 303 |
Chain | Residue |
S | SER58 |
S | SER60 |
site_id | AK3 |
Number of Residues | 5 |
Details | binding site for residue K S 304 |
Chain | Residue |
S | VAL183 |
S | ARG184 |
S | SER186 |
S | PHE189 |
S | HOH419 |
site_id | AK4 |
Number of Residues | 4 |
Details | binding site for residue PO4 S 305 |
Chain | Residue |
S | PRO82 |
S | GLY83 |
S | ARG85 |
S | LYS111 |
site_id | AK5 |
Number of Residues | 9 |
Details | binding site for residue 6PQ T 301 |
Chain | Residue |
P | ASP178 |
T | GLY66 |
T | MET89 |
T | GLU90 |
T | ILE91 |
T | SER119 |
T | GLN120 |
T | HIS142 |
T | TRP143 |
site_id | AK6 |
Number of Residues | 6 |
Details | binding site for residue K T 302 |
Chain | Residue |
S | GLU199 |
S | HOH413 |
T | ASN41 |
T | ASP141 |
T | ASP169 |
T | ASN170 |
site_id | AK7 |
Number of Residues | 6 |
Details | binding site for residue K T 303 |
Chain | Residue |
F | HOH422 |
T | VAL183 |
T | ARG184 |
T | SER186 |
T | PHE189 |
T | HOH422 |
site_id | AK8 |
Number of Residues | 5 |
Details | binding site for residue PO4 T 304 |
Chain | Residue |
T | PRO82 |
T | GLY83 |
T | ARG85 |
T | LYS111 |
T | HOH402 |
site_id | AK9 |
Number of Residues | 10 |
Details | binding site for residue 6PQ U 301 |
Chain | Residue |
L | LEU148 |
U | GLY66 |
U | GLU90 |
U | ILE91 |
U | SER119 |
U | GLN120 |
U | HIS142 |
U | TRP143 |
U | ARG146 |
V | MET201 |
site_id | AL1 |
Number of Residues | 6 |
Details | binding site for residue K U 302 |
Chain | Residue |
U | ASN41 |
U | ASP141 |
U | ASP169 |
U | ASN170 |
V | GLU199 |
V | HOH411 |
site_id | AL2 |
Number of Residues | 4 |
Details | binding site for residue K U 303 |
Chain | Residue |
U | VAL183 |
U | ARG184 |
U | SER186 |
U | PHE189 |
site_id | AL3 |
Number of Residues | 11 |
Details | binding site for residue 6PQ V 301 |
Chain | Residue |
J | LEU148 |
J | ASP178 |
V | GLY66 |
V | MET89 |
V | GLU90 |
V | ILE91 |
V | ALA118 |
V | SER119 |
V | GLN120 |
V | HIS142 |
V | TRP143 |
site_id | AL4 |
Number of Residues | 5 |
Details | binding site for residue K V 302 |
Chain | Residue |
U | GLU199 |
V | ASN41 |
V | ASP141 |
V | ASP169 |
V | ASN170 |
site_id | AL5 |
Number of Residues | 5 |
Details | binding site for residue K V 303 |
Chain | Residue |
V | VAL183 |
V | ARG184 |
V | SER186 |
V | PHE189 |
V | HOH415 |
site_id | AL6 |
Number of Residues | 3 |
Details | binding site for residue PO4 V 304 |
Chain | Residue |
V | GLY83 |
V | ARG85 |
V | LYS111 |
site_id | AL7 |
Number of Residues | 10 |
Details | binding site for residue 6PQ W 301 |
Chain | Residue |
A | ASP178 |
E | MET201 |
W | MET89 |
W | GLU90 |
W | ILE91 |
W | ALA118 |
W | SER119 |
W | GLN120 |
W | HIS142 |
W | TRP143 |
site_id | AL8 |
Number of Residues | 6 |
Details | binding site for residue K W 302 |
Chain | Residue |
E | GLU199 |
W | ASN41 |
W | ASP141 |
W | ASP169 |
W | ASN170 |
W | HOH411 |
site_id | AL9 |
Number of Residues | 5 |
Details | binding site for residue K W 303 |
Chain | Residue |
W | VAL183 |
W | ARG184 |
W | SER186 |
W | PHE189 |
W | HOH409 |
site_id | AM1 |
Number of Residues | 4 |
Details | binding site for residue PO4 W 304 |
Chain | Residue |
W | PRO82 |
W | GLY83 |
W | ARG85 |
W | LYS111 |
site_id | AM2 |
Number of Residues | 14 |
Details | binding site for residue 6PQ X 301 |
Chain | Residue |
P | MET201 |
P | LYS202 |
S | LEU148 |
S | ASP178 |
X | GLY66 |
X | MET89 |
X | GLU90 |
X | ILE91 |
X | GLY117 |
X | ALA118 |
X | SER119 |
X | GLN120 |
X | HIS142 |
X | TRP143 |
site_id | AM3 |
Number of Residues | 6 |
Details | binding site for residue K X 302 |
Chain | Residue |
P | GLU199 |
P | HOH407 |
X | ASN41 |
X | ASP141 |
X | ASP169 |
X | ASN170 |
site_id | AM4 |
Number of Residues | 6 |
Details | binding site for residue K X 303 |
Chain | Residue |
I | HOH407 |
X | VAL183 |
X | ARG184 |
X | SER186 |
X | PHE189 |
X | HOH408 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 384 |
Details | TRANSMEM: Helical; Signal-anchor for type II membrane protein => ECO:0000255 |
Chain | Residue | Details |
A | ASP3-PRO19 | |
J | ASP3-PRO19 | |
K | ASP3-PRO19 | |
L | ASP3-PRO19 | |
M | ASP3-PRO19 | |
N | ASP3-PRO19 | |
O | ASP3-PRO19 | |
P | ASP3-PRO19 | |
Q | ASP3-PRO19 | |
R | ASP3-PRO19 | |
S | ASP3-PRO19 | |
B | ASP3-PRO19 | |
T | ASP3-PRO19 | |
U | ASP3-PRO19 | |
V | ASP3-PRO19 | |
W | ASP3-PRO19 | |
X | ASP3-PRO19 | |
C | ASP3-PRO19 | |
D | ASP3-PRO19 | |
E | ASP3-PRO19 | |
F | ASP3-PRO19 | |
G | ASP3-PRO19 | |
H | ASP3-PRO19 | |
I | ASP3-PRO19 |
site_id | SWS_FT_FI2 |
Number of Residues | 96 |
Details | BINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU01019, ECO:0000269|PubMed:12237326 |
Chain | Residue | Details |
A | ARG85 | |
C | LEU115 | |
C | ASP133 | |
C | ARG184 | |
D | ARG85 | |
D | LEU115 | |
D | ASP133 | |
D | ARG184 | |
E | ARG85 | |
E | LEU115 | |
E | ASP133 | |
A | LEU115 | |
E | ARG184 | |
F | ARG85 | |
F | LEU115 | |
F | ASP133 | |
F | ARG184 | |
G | ARG85 | |
G | LEU115 | |
G | ASP133 | |
G | ARG184 | |
H | ARG85 | |
A | ASP133 | |
H | LEU115 | |
H | ASP133 | |
H | ARG184 | |
I | ARG85 | |
I | LEU115 | |
I | ASP133 | |
I | ARG184 | |
J | ARG85 | |
J | LEU115 | |
J | ASP133 | |
A | ARG184 | |
J | ARG184 | |
K | ARG85 | |
K | LEU115 | |
K | ASP133 | |
K | ARG184 | |
L | ARG85 | |
L | LEU115 | |
L | ASP133 | |
L | ARG184 | |
M | ARG85 | |
B | ARG85 | |
M | LEU115 | |
M | ASP133 | |
M | ARG184 | |
N | ARG85 | |
N | LEU115 | |
N | ASP133 | |
N | ARG184 | |
O | ARG85 | |
O | LEU115 | |
O | ASP133 | |
B | LEU115 | |
O | ARG184 | |
P | ARG85 | |
P | LEU115 | |
P | ASP133 | |
P | ARG184 | |
Q | ARG85 | |
Q | LEU115 | |
Q | ASP133 | |
Q | ARG184 | |
R | ARG85 | |
B | ASP133 | |
R | LEU115 | |
R | ASP133 | |
R | ARG184 | |
S | ARG85 | |
S | LEU115 | |
S | ASP133 | |
S | ARG184 | |
T | ARG85 | |
T | LEU115 | |
T | ASP133 | |
B | ARG184 | |
T | ARG184 | |
U | ARG85 | |
U | LEU115 | |
U | ASP133 | |
U | ARG184 | |
V | ARG85 | |
V | LEU115 | |
V | ASP133 | |
V | ARG184 | |
W | ARG85 | |
C | ARG85 | |
W | LEU115 | |
W | ASP133 | |
W | ARG184 | |
X | ARG85 | |
X | LEU115 | |
X | ASP133 | |
X | ARG184 |
site_id | SWS_FT_FI3 |
Number of Residues | 72 |
Details | BINDING: BINDING => ECO:0000255|PROSITE-ProRule:PRU01019 |
Chain | Residue | Details |
A | GLY107 | |
D | GLY107 | |
D | THR134 | |
D | LYS162 | |
E | GLY107 | |
E | THR134 | |
E | LYS162 | |
F | GLY107 | |
F | THR134 | |
F | LYS162 | |
G | GLY107 | |
A | THR134 | |
G | THR134 | |
G | LYS162 | |
H | GLY107 | |
H | THR134 | |
H | LYS162 | |
I | GLY107 | |
I | THR134 | |
I | LYS162 | |
J | GLY107 | |
J | THR134 | |
A | LYS162 | |
J | LYS162 | |
K | GLY107 | |
K | THR134 | |
K | LYS162 | |
L | GLY107 | |
L | THR134 | |
L | LYS162 | |
M | GLY107 | |
M | THR134 | |
M | LYS162 | |
B | GLY107 | |
N | GLY107 | |
N | THR134 | |
N | LYS162 | |
O | GLY107 | |
O | THR134 | |
O | LYS162 | |
P | GLY107 | |
P | THR134 | |
P | LYS162 | |
Q | GLY107 | |
B | THR134 | |
Q | THR134 | |
Q | LYS162 | |
R | GLY107 | |
R | THR134 | |
R | LYS162 | |
S | GLY107 | |
S | THR134 | |
S | LYS162 | |
T | GLY107 | |
T | THR134 | |
B | LYS162 | |
T | LYS162 | |
U | GLY107 | |
U | THR134 | |
U | LYS162 | |
V | GLY107 | |
V | THR134 | |
V | LYS162 | |
W | GLY107 | |
W | THR134 | |
W | LYS162 | |
C | GLY107 | |
X | GLY107 | |
X | THR134 | |
X | LYS162 | |
C | THR134 | |
C | LYS162 |
site_id | SWS_FT_FI4 |
Number of Residues | 96 |
Details | BINDING: |
Chain | Residue | Details |
A | LEU160 | |
C | SER187 | |
C | TYR212 | |
C | GLN213 | |
D | LEU160 | |
D | SER187 | |
D | TYR212 | |
D | GLN213 | |
E | LEU160 | |
E | SER187 | |
E | TYR212 | |
A | SER187 | |
E | GLN213 | |
F | LEU160 | |
F | SER187 | |
F | TYR212 | |
F | GLN213 | |
G | LEU160 | |
G | SER187 | |
G | TYR212 | |
G | GLN213 | |
H | LEU160 | |
A | TYR212 | |
H | SER187 | |
H | TYR212 | |
H | GLN213 | |
I | LEU160 | |
I | SER187 | |
I | TYR212 | |
I | GLN213 | |
J | LEU160 | |
J | SER187 | |
J | TYR212 | |
A | GLN213 | |
J | GLN213 | |
K | LEU160 | |
K | SER187 | |
K | TYR212 | |
K | GLN213 | |
L | LEU160 | |
L | SER187 | |
L | TYR212 | |
L | GLN213 | |
M | LEU160 | |
B | LEU160 | |
M | SER187 | |
M | TYR212 | |
M | GLN213 | |
N | LEU160 | |
N | SER187 | |
N | TYR212 | |
N | GLN213 | |
O | LEU160 | |
O | SER187 | |
O | TYR212 | |
B | SER187 | |
O | GLN213 | |
P | LEU160 | |
P | SER187 | |
P | TYR212 | |
P | GLN213 | |
Q | LEU160 | |
Q | SER187 | |
Q | TYR212 | |
Q | GLN213 | |
R | LEU160 | |
B | TYR212 | |
R | SER187 | |
R | TYR212 | |
R | GLN213 | |
S | LEU160 | |
S | SER187 | |
S | TYR212 | |
S | GLN213 | |
T | LEU160 | |
T | SER187 | |
T | TYR212 | |
B | GLN213 | |
T | GLN213 | |
U | LEU160 | |
U | SER187 | |
U | TYR212 | |
U | GLN213 | |
V | LEU160 | |
V | SER187 | |
V | TYR212 | |
V | GLN213 | |
W | LEU160 | |
C | LEU160 | |
W | SER187 | |
W | TYR212 | |
W | GLN213 | |
X | LEU160 | |
X | SER187 | |
X | TYR212 | |
X | GLN213 |
Catalytic Information from CSA
site_id | MCSA1 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
A | ARG184 | metal ligand |
A | SER187 | proton shuttle (general acid/base) |
A | TYR212 | metal ligand |
A | GLN213 | metal ligand |
site_id | MCSA10 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
J | ARG184 | metal ligand |
J | SER187 | proton shuttle (general acid/base) |
J | TYR212 | metal ligand |
J | GLN213 | metal ligand |
site_id | MCSA11 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
K | ARG184 | metal ligand |
K | SER187 | proton shuttle (general acid/base) |
K | TYR212 | metal ligand |
K | GLN213 | metal ligand |
site_id | MCSA12 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
L | ARG184 | metal ligand |
L | SER187 | proton shuttle (general acid/base) |
L | TYR212 | metal ligand |
L | GLN213 | metal ligand |
site_id | MCSA13 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
M | ARG184 | metal ligand |
M | SER187 | proton shuttle (general acid/base) |
M | TYR212 | metal ligand |
M | GLN213 | metal ligand |
site_id | MCSA14 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
N | ARG184 | metal ligand |
N | SER187 | proton shuttle (general acid/base) |
N | TYR212 | metal ligand |
N | GLN213 | metal ligand |
site_id | MCSA15 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
O | ARG184 | metal ligand |
O | SER187 | proton shuttle (general acid/base) |
O | TYR212 | metal ligand |
O | GLN213 | metal ligand |
site_id | MCSA16 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
P | ARG184 | metal ligand |
P | SER187 | proton shuttle (general acid/base) |
P | TYR212 | metal ligand |
P | GLN213 | metal ligand |
site_id | MCSA17 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
Q | ARG184 | metal ligand |
Q | SER187 | proton shuttle (general acid/base) |
Q | TYR212 | metal ligand |
Q | GLN213 | metal ligand |
site_id | MCSA18 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
R | ARG184 | metal ligand |
R | SER187 | proton shuttle (general acid/base) |
R | TYR212 | metal ligand |
R | GLN213 | metal ligand |
site_id | MCSA19 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
S | ARG184 | metal ligand |
S | SER187 | proton shuttle (general acid/base) |
S | TYR212 | metal ligand |
S | GLN213 | metal ligand |
site_id | MCSA2 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
B | ARG184 | metal ligand |
B | SER187 | proton shuttle (general acid/base) |
B | TYR212 | metal ligand |
B | GLN213 | metal ligand |
site_id | MCSA20 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
T | ARG184 | metal ligand |
T | SER187 | proton shuttle (general acid/base) |
T | TYR212 | metal ligand |
T | GLN213 | metal ligand |
site_id | MCSA21 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
U | ARG184 | metal ligand |
U | SER187 | proton shuttle (general acid/base) |
U | TYR212 | metal ligand |
U | GLN213 | metal ligand |
site_id | MCSA22 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
V | ARG184 | metal ligand |
V | SER187 | proton shuttle (general acid/base) |
V | TYR212 | metal ligand |
V | GLN213 | metal ligand |
site_id | MCSA23 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
W | ARG184 | metal ligand |
W | SER187 | proton shuttle (general acid/base) |
W | TYR212 | metal ligand |
W | GLN213 | metal ligand |
site_id | MCSA24 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
X | ARG184 | metal ligand |
X | SER187 | proton shuttle (general acid/base) |
X | TYR212 | metal ligand |
X | GLN213 | metal ligand |
site_id | MCSA3 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
C | ARG184 | metal ligand |
C | SER187 | proton shuttle (general acid/base) |
C | TYR212 | metal ligand |
C | GLN213 | metal ligand |
site_id | MCSA4 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
D | ARG184 | metal ligand |
D | SER187 | proton shuttle (general acid/base) |
D | TYR212 | metal ligand |
D | GLN213 | metal ligand |
site_id | MCSA5 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
E | ARG184 | metal ligand |
E | SER187 | proton shuttle (general acid/base) |
E | TYR212 | metal ligand |
E | GLN213 | metal ligand |
site_id | MCSA6 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
F | ARG184 | metal ligand |
F | SER187 | proton shuttle (general acid/base) |
F | TYR212 | metal ligand |
F | GLN213 | metal ligand |
site_id | MCSA7 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
G | ARG184 | metal ligand |
G | SER187 | proton shuttle (general acid/base) |
G | TYR212 | metal ligand |
G | GLN213 | metal ligand |
site_id | MCSA8 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
H | ARG184 | metal ligand |
H | SER187 | proton shuttle (general acid/base) |
H | TYR212 | metal ligand |
H | GLN213 | metal ligand |
site_id | MCSA9 |
Number of Residues | 4 |
Details | M-CSA 915 |
Chain | Residue | Details |
I | ARG184 | metal ligand |
I | SER187 | proton shuttle (general acid/base) |
I | TYR212 | metal ligand |
I | GLN213 | metal ligand |