2CHT
CRYSTAL STRUCTURES OF THE MONOFUNCTIONAL CHORISMATE MUTASE FROM BACILLUS SUBTILIS AND ITS COMPLEX WITH A TRANSITION STATE ANALOG
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0004106 | molecular_function | chorismate mutase activity |
A | 0005737 | cellular_component | cytoplasm |
A | 0008652 | biological_process | amino acid biosynthetic process |
A | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
A | 0016853 | molecular_function | isomerase activity |
A | 0046417 | biological_process | chorismate metabolic process |
B | 0004106 | molecular_function | chorismate mutase activity |
B | 0005737 | cellular_component | cytoplasm |
B | 0008652 | biological_process | amino acid biosynthetic process |
B | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
B | 0016853 | molecular_function | isomerase activity |
B | 0046417 | biological_process | chorismate metabolic process |
C | 0004106 | molecular_function | chorismate mutase activity |
C | 0005737 | cellular_component | cytoplasm |
C | 0008652 | biological_process | amino acid biosynthetic process |
C | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
C | 0016853 | molecular_function | isomerase activity |
C | 0046417 | biological_process | chorismate metabolic process |
D | 0004106 | molecular_function | chorismate mutase activity |
D | 0005737 | cellular_component | cytoplasm |
D | 0008652 | biological_process | amino acid biosynthetic process |
D | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
D | 0016853 | molecular_function | isomerase activity |
D | 0046417 | biological_process | chorismate metabolic process |
E | 0004106 | molecular_function | chorismate mutase activity |
E | 0005737 | cellular_component | cytoplasm |
E | 0008652 | biological_process | amino acid biosynthetic process |
E | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
E | 0016853 | molecular_function | isomerase activity |
E | 0046417 | biological_process | chorismate metabolic process |
F | 0004106 | molecular_function | chorismate mutase activity |
F | 0005737 | cellular_component | cytoplasm |
F | 0008652 | biological_process | amino acid biosynthetic process |
F | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
F | 0016853 | molecular_function | isomerase activity |
F | 0046417 | biological_process | chorismate metabolic process |
G | 0004106 | molecular_function | chorismate mutase activity |
G | 0005737 | cellular_component | cytoplasm |
G | 0008652 | biological_process | amino acid biosynthetic process |
G | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
G | 0016853 | molecular_function | isomerase activity |
G | 0046417 | biological_process | chorismate metabolic process |
H | 0004106 | molecular_function | chorismate mutase activity |
H | 0005737 | cellular_component | cytoplasm |
H | 0008652 | biological_process | amino acid biosynthetic process |
H | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
H | 0016853 | molecular_function | isomerase activity |
H | 0046417 | biological_process | chorismate metabolic process |
I | 0004106 | molecular_function | chorismate mutase activity |
I | 0005737 | cellular_component | cytoplasm |
I | 0008652 | biological_process | amino acid biosynthetic process |
I | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
I | 0016853 | molecular_function | isomerase activity |
I | 0046417 | biological_process | chorismate metabolic process |
J | 0004106 | molecular_function | chorismate mutase activity |
J | 0005737 | cellular_component | cytoplasm |
J | 0008652 | biological_process | amino acid biosynthetic process |
J | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
J | 0016853 | molecular_function | isomerase activity |
J | 0046417 | biological_process | chorismate metabolic process |
K | 0004106 | molecular_function | chorismate mutase activity |
K | 0005737 | cellular_component | cytoplasm |
K | 0008652 | biological_process | amino acid biosynthetic process |
K | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
K | 0016853 | molecular_function | isomerase activity |
K | 0046417 | biological_process | chorismate metabolic process |
L | 0004106 | molecular_function | chorismate mutase activity |
L | 0005737 | cellular_component | cytoplasm |
L | 0008652 | biological_process | amino acid biosynthetic process |
L | 0009073 | biological_process | aromatic amino acid family biosynthetic process |
L | 0016853 | molecular_function | isomerase activity |
L | 0046417 | biological_process | chorismate metabolic process |
Functional Information from PDB Data
site_id | AAB |
Number of Residues | 12 |
Details | active site shared by chain A and B |
Chain | Residue |
A | PHE57 |
B | TYR108 |
B | LEU115 |
B | ARG116 |
A | PRO58 |
A | ALA59 |
A | LYS60 |
A | THR74 |
A | CYS75 |
B | ARG7 |
B | GLU78 |
B | ARG90 |
site_id | ABC |
Number of Residues | 12 |
Details | active site shared by chain B and C |
Chain | Residue |
B | PHE57 |
B | PRO58 |
B | ALA59 |
B | LYS60 |
B | THR74 |
B | CYS75 |
C | ARG7 |
C | GLU78 |
C | ARG90 |
C | TYR108 |
C | LEU115 |
C | ARG116 |
site_id | AC1 |
Number of Residues | 12 |
Details | BINDING SITE FOR RESIDUE TSA B 201 |
Chain | Residue |
A | PHE57 |
A | ALA59 |
A | LYS60 |
A | ARG63 |
A | VAL73 |
A | THR74 |
A | CYS75 |
B | ARG7 |
B | GLU78 |
B | ARG90 |
B | TYR108 |
B | LEU115 |
site_id | AC2 |
Number of Residues | 12 |
Details | BINDING SITE FOR RESIDUE TSA C 202 |
Chain | Residue |
B | PHE57 |
B | ALA59 |
B | LYS60 |
B | VAL73 |
B | THR74 |
B | CYS75 |
C | ARG7 |
C | GLU78 |
C | ARG90 |
C | TYR108 |
C | LEU115 |
C | HOH209 |
site_id | AC3 |
Number of Residues | 13 |
Details | BINDING SITE FOR RESIDUE TSA A 203 |
Chain | Residue |
A | ARG7 |
A | GLU78 |
A | ARG90 |
A | TYR108 |
A | LEU115 |
A | HOH210 |
C | PHE57 |
C | ALA59 |
C | LYS60 |
C | ARG63 |
C | VAL73 |
C | THR74 |
C | CYS75 |
site_id | AC4 |
Number of Residues | 12 |
Details | BINDING SITE FOR RESIDUE TSA E 204 |
Chain | Residue |
D | PHE57 |
D | ALA59 |
D | LYS60 |
D | ARG63 |
D | VAL73 |
D | THR74 |
D | CYS75 |
E | ARG7 |
E | GLU78 |
E | ARG90 |
E | TYR108 |
E | LEU115 |
site_id | AC5 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE TSA F 205 |
Chain | Residue |
E | PHE57 |
E | ALA59 |
E | LYS60 |
E | VAL73 |
E | THR74 |
E | CYS75 |
F | ARG7 |
F | GLU78 |
F | ARG90 |
F | TYR108 |
site_id | AC6 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE TSA D 206 |
Chain | Residue |
D | ARG7 |
D | GLU78 |
D | ARG90 |
D | TYR108 |
F | PHE57 |
F | ALA59 |
F | LYS60 |
F | VAL73 |
F | THR74 |
F | CYS75 |
site_id | AC7 |
Number of Residues | 11 |
Details | BINDING SITE FOR RESIDUE TSA H 207 |
Chain | Residue |
G | PHE57 |
G | ALA59 |
G | LYS60 |
G | THR74 |
G | CYS75 |
H | ARG7 |
H | GLU78 |
H | ARG90 |
H | TYR108 |
H | LEU115 |
H | ARG116 |
site_id | AC8 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE TSA I 208 |
Chain | Residue |
H | PHE57 |
H | ALA59 |
H | LYS60 |
H | VAL73 |
H | THR74 |
H | CYS75 |
I | ARG7 |
I | GLU78 |
I | ARG90 |
I | TYR108 |
site_id | AC9 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE TSA G 209 |
Chain | Residue |
G | ARG7 |
G | GLU78 |
G | ARG90 |
G | TYR108 |
I | PHE57 |
I | ALA59 |
I | LYS60 |
I | VAL73 |
I | THR74 |
I | CYS75 |
site_id | ACA |
Number of Residues | 11 |
Details | active site shared by chain C and A |
Chain | Residue |
C | PHE57 |
C | PRO58 |
C | ALA59 |
C | LYS60 |
C | THR74 |
C | CYS75 |
A | ARG7 |
A | GLU78 |
A | ARG90 |
A | TYR108 |
A | LEU115 |
site_id | ADE |
Number of Residues | 12 |
Details | active site shared by chain D and E |
Chain | Residue |
D | PHE57 |
D | PRO58 |
D | ALA59 |
D | LYS60 |
D | THR74 |
D | CYS75 |
E | ARG7 |
E | GLU78 |
E | ARG90 |
E | TYR108 |
E | LEU115 |
E | ARG116 |
site_id | AEF |
Number of Residues | 12 |
Details | active site shared by chain E and F |
Chain | Residue |
E | PHE57 |
E | PRO58 |
E | ALA59 |
E | LYS60 |
E | THR74 |
E | CYS75 |
F | ARG7 |
F | GLU78 |
F | ARG90 |
F | TYR108 |
F | LEU115 |
F | ARG116 |
site_id | AFD |
Number of Residues | 11 |
Details | active site shared by chain F and D |
Chain | Residue |
F | PHE57 |
F | PRO58 |
F | ALA59 |
F | LYS60 |
F | THR74 |
F | CYS75 |
D | ARG7 |
D | GLU78 |
D | ARG90 |
D | TYR108 |
D | LEU115 |
site_id | AGH |
Number of Residues | 12 |
Details | active site shared by chain G and H |
Chain | Residue |
G | PHE57 |
G | PRO58 |
G | ALA59 |
G | LYS60 |
G | THR74 |
G | CYS75 |
H | ARG7 |
H | GLU78 |
H | ARG90 |
H | TYR108 |
H | LEU115 |
H | ARG116 |
site_id | AHI |
Number of Residues | 11 |
Details | active site shared by chain H and I |
Chain | Residue |
H | PHE57 |
H | PRO58 |
H | ALA59 |
H | LYS60 |
H | THR74 |
H | CYS75 |
I | ARG7 |
I | GLU78 |
I | ARG90 |
I | TYR108 |
I | LEU115 |
site_id | AIG |
Number of Residues | 12 |
Details | active site shared by chain I and G |
Chain | Residue |
G | ARG7 |
G | GLU78 |
G | ARG90 |
G | TYR108 |
G | LEU115 |
G | ARG116 |
I | PHE57 |
I | PRO58 |
I | ALA59 |
I | LYS60 |
I | THR74 |
I | CYS75 |
site_id | AJK |
Number of Residues | 12 |
Details | active site shared by chain J and K |
Chain | Residue |
J | PHE57 |
J | PRO58 |
J | ALA59 |
J | LYS60 |
J | THR74 |
J | CYS75 |
K | ARG7 |
K | GLU78 |
K | ARG90 |
K | TYR108 |
K | LEU115 |
K | ARG116 |
site_id | AKL |
Number of Residues | 11 |
Details | active site shared by chain K and L |
Chain | Residue |
K | PHE57 |
K | PRO58 |
K | ALA59 |
K | LYS60 |
K | THR74 |
K | CYS75 |
L | ARG7 |
L | GLU78 |
L | ARG90 |
L | TYR108 |
L | LEU115 |
site_id | ALJ |
Number of Residues | 12 |
Details | active site shared by chain L and J |
Chain | Residue |
L | PHE57 |
L | PRO58 |
L | ALA59 |
L | LYS60 |
L | THR74 |
L | CYS75 |
J | ARG7 |
J | GLU78 |
J | ARG90 |
J | TYR108 |
J | LEU115 |
J | ARG116 |
site_id | BC1 |
Number of Residues | 12 |
Details | BINDING SITE FOR RESIDUE TSA K 210 |
Chain | Residue |
J | PHE57 |
J | ALA59 |
J | LYS60 |
J | VAL73 |
J | THR74 |
J | CYS75 |
K | ARG7 |
K | GLU78 |
K | ARG90 |
K | TYR108 |
K | LEU115 |
K | ARG116 |
site_id | BC2 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE TSA L 211 |
Chain | Residue |
K | PHE57 |
K | ALA59 |
K | LYS60 |
K | VAL73 |
K | THR74 |
K | CYS75 |
L | ARG7 |
L | GLU78 |
L | ARG90 |
L | TYR108 |
site_id | BC3 |
Number of Residues | 12 |
Details | BINDING SITE FOR RESIDUE TSA J 212 |
Chain | Residue |
J | ARG7 |
J | GLU78 |
J | ARG90 |
J | TYR108 |
J | ARG116 |
J | HOH239 |
L | PHE57 |
L | ALA59 |
L | LYS60 |
L | VAL73 |
L | THR74 |
L | CYS75 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 48 |
Details | BINDING: BINDING => ECO:0000269|PubMed:8046752, ECO:0007744|PDB:1COM |
Chain | Residue | Details |
A | ARG7 | |
C | THR74 | |
C | ARG90 | |
C | TYR108 | |
D | ARG7 | |
D | THR74 | |
D | ARG90 | |
D | TYR108 | |
E | ARG7 | |
E | THR74 | |
E | ARG90 | |
A | THR74 | |
E | TYR108 | |
F | ARG7 | |
F | THR74 | |
F | ARG90 | |
F | TYR108 | |
G | ARG7 | |
G | THR74 | |
G | ARG90 | |
G | TYR108 | |
H | ARG7 | |
A | ARG90 | |
H | THR74 | |
H | ARG90 | |
H | TYR108 | |
I | ARG7 | |
I | THR74 | |
I | ARG90 | |
I | TYR108 | |
J | ARG7 | |
J | THR74 | |
J | ARG90 | |
A | TYR108 | |
J | TYR108 | |
K | ARG7 | |
K | THR74 | |
K | ARG90 | |
K | TYR108 | |
L | ARG7 | |
L | THR74 | |
L | ARG90 | |
L | TYR108 | |
B | ARG7 | |
B | THR74 | |
B | ARG90 | |
B | TYR108 | |
C | ARG7 |
Catalytic Information from CSA
site_id | CSA1 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
A | ARG90 |
site_id | CSA10 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
J | ARG90 |
site_id | CSA11 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
K | ARG90 |
site_id | CSA12 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
L | ARG90 |
site_id | CSA2 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
B | ARG90 |
site_id | CSA3 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
C | ARG90 |
site_id | CSA4 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
D | ARG90 |
site_id | CSA5 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
E | ARG90 |
site_id | CSA6 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
F | ARG90 |
site_id | CSA7 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
G | ARG90 |
site_id | CSA8 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
H | ARG90 |
site_id | CSA9 |
Number of Residues | 1 |
Details | Annotated By Reference To The Literature 1dbf |
Chain | Residue | Details |
I | ARG90 |
site_id | MCSA1 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
A | ARG7 | transition state stabiliser |
A | ARG63 | transition state stabiliser |
A | CYS75 | transition state stabiliser |
A | GLU78 | transition state stabiliser |
A | ARG90 | transition state stabiliser |
A | TYR108 | transition state stabiliser |
A | ARG116 | transition state stabiliser |
site_id | MCSA10 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
J | ARG7 | transition state stabiliser |
J | ARG63 | transition state stabiliser |
J | CYS75 | transition state stabiliser |
J | GLU78 | transition state stabiliser |
J | ARG90 | transition state stabiliser |
J | TYR108 | transition state stabiliser |
J | ARG116 | transition state stabiliser |
site_id | MCSA11 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
K | ARG7 | transition state stabiliser |
K | ARG63 | transition state stabiliser |
K | CYS75 | transition state stabiliser |
K | GLU78 | transition state stabiliser |
K | ARG90 | transition state stabiliser |
K | TYR108 | transition state stabiliser |
K | ARG116 | transition state stabiliser |
site_id | MCSA12 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
L | ARG7 | transition state stabiliser |
L | ARG63 | transition state stabiliser |
L | CYS75 | transition state stabiliser |
L | GLU78 | transition state stabiliser |
L | ARG90 | transition state stabiliser |
L | TYR108 | transition state stabiliser |
L | ARG116 | transition state stabiliser |
site_id | MCSA2 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
B | ARG7 | transition state stabiliser |
B | ARG63 | transition state stabiliser |
B | CYS75 | transition state stabiliser |
B | GLU78 | transition state stabiliser |
B | ARG90 | transition state stabiliser |
B | TYR108 | transition state stabiliser |
B | ARG116 | transition state stabiliser |
site_id | MCSA3 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
C | ARG7 | transition state stabiliser |
C | ARG63 | transition state stabiliser |
C | CYS75 | transition state stabiliser |
C | GLU78 | transition state stabiliser |
C | ARG90 | transition state stabiliser |
C | TYR108 | transition state stabiliser |
C | ARG116 | transition state stabiliser |
site_id | MCSA4 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
D | ARG7 | transition state stabiliser |
D | ARG63 | transition state stabiliser |
D | CYS75 | transition state stabiliser |
D | GLU78 | transition state stabiliser |
D | ARG90 | transition state stabiliser |
D | TYR108 | transition state stabiliser |
D | ARG116 | transition state stabiliser |
site_id | MCSA5 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
E | ARG7 | transition state stabiliser |
E | ARG63 | transition state stabiliser |
E | CYS75 | transition state stabiliser |
E | GLU78 | transition state stabiliser |
E | ARG90 | transition state stabiliser |
E | TYR108 | transition state stabiliser |
E | ARG116 | transition state stabiliser |
site_id | MCSA6 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
F | ARG7 | transition state stabiliser |
F | ARG63 | transition state stabiliser |
F | CYS75 | transition state stabiliser |
F | GLU78 | transition state stabiliser |
F | ARG90 | transition state stabiliser |
F | TYR108 | transition state stabiliser |
F | ARG116 | transition state stabiliser |
site_id | MCSA7 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
G | ARG7 | transition state stabiliser |
G | ARG63 | transition state stabiliser |
G | CYS75 | transition state stabiliser |
G | GLU78 | transition state stabiliser |
G | ARG90 | transition state stabiliser |
G | TYR108 | transition state stabiliser |
G | ARG116 | transition state stabiliser |
site_id | MCSA8 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
H | ARG7 | transition state stabiliser |
H | ARG63 | transition state stabiliser |
H | CYS75 | transition state stabiliser |
H | GLU78 | transition state stabiliser |
H | ARG90 | transition state stabiliser |
H | TYR108 | transition state stabiliser |
H | ARG116 | transition state stabiliser |
site_id | MCSA9 |
Number of Residues | 7 |
Details | M-CSA 474 |
Chain | Residue | Details |
I | ARG7 | transition state stabiliser |
I | ARG63 | transition state stabiliser |
I | CYS75 | transition state stabiliser |
I | GLU78 | transition state stabiliser |
I | ARG90 | transition state stabiliser |
I | TYR108 | transition state stabiliser |
I | ARG116 | transition state stabiliser |