6T6N
Crystal structure of Klebsiella pneumoniae FabG2(NADH-dependent) in complex with NADH at 2.5 A resolution
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
A | 0016491 | molecular_function | oxidoreductase activity |
B | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
B | 0016491 | molecular_function | oxidoreductase activity |
C | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
C | 0016491 | molecular_function | oxidoreductase activity |
D | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
D | 0016491 | molecular_function | oxidoreductase activity |
E | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
E | 0016491 | molecular_function | oxidoreductase activity |
F | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
F | 0016491 | molecular_function | oxidoreductase activity |
G | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
G | 0016491 | molecular_function | oxidoreductase activity |
H | 0004316 | molecular_function | 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity |
H | 0016491 | molecular_function | oxidoreductase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 6 |
Details | binding site for residue GOL A 301 |
Chain | Residue |
A | ALA141 |
A | TRP143 |
A | ASN237 |
A | MET242 |
A | VAL243 |
A | LEU244 |
site_id | AC2 |
Number of Residues | 25 |
Details | binding site for residue NAI A 302 |
Chain | Residue |
A | ILE17 |
A | ASP36 |
A | ARG37 |
A | CYS60 |
A | ASN61 |
A | ILE62 |
A | ASN88 |
A | ALA89 |
A | GLY90 |
A | VAL111 |
A | ILE138 |
A | ALA139 |
A | SER140 |
A | TYR152 |
A | LYS156 |
A | PRO182 |
A | GLY183 |
A | ILE185 |
A | THR187 |
A | MET189 |
A | THR190 |
A | HOH409 |
A | GLY12 |
A | ALA14 |
A | GLY16 |
site_id | AC3 |
Number of Residues | 3 |
Details | binding site for residue GOL B 301 |
Chain | Residue |
B | ALA14 |
B | HIS40 |
B | ALA44 |
site_id | AC4 |
Number of Residues | 3 |
Details | binding site for residue GOL B 302 |
Chain | Residue |
B | ARG229 |
C | TYR209 |
C | GLU212 |
site_id | AC5 |
Number of Residues | 25 |
Details | binding site for residue NAI B 303 |
Chain | Residue |
B | GLY12 |
B | ALA14 |
B | ARG15 |
B | GLY16 |
B | ILE17 |
B | ASP36 |
B | ARG37 |
B | CYS60 |
B | ASN61 |
B | ILE62 |
B | ASN88 |
B | ALA89 |
B | GLY90 |
B | VAL111 |
B | ILE138 |
B | ALA139 |
B | SER140 |
B | TYR152 |
B | LYS156 |
B | PRO182 |
B | GLY183 |
B | PHE184 |
B | ILE185 |
B | THR187 |
B | THR190 |
site_id | AC6 |
Number of Residues | 3 |
Details | binding site for residue GOL C 301 |
Chain | Residue |
C | ALA14 |
C | ARG15 |
C | HIS40 |
site_id | AC7 |
Number of Residues | 7 |
Details | binding site for residue GOL C 302 |
Chain | Residue |
C | ALA141 |
C | TRP143 |
C | ASN237 |
C | MET242 |
C | VAL243 |
C | LEU244 |
C | HOH419 |
site_id | AC8 |
Number of Residues | 3 |
Details | binding site for residue GOL C 303 |
Chain | Residue |
C | LYS99 |
C | LEU100 |
D | LYS65 |
site_id | AC9 |
Number of Residues | 26 |
Details | binding site for residue NAI C 304 |
Chain | Residue |
C | HOH403 |
C | HOH418 |
C | GLY12 |
C | ALA14 |
C | ARG15 |
C | GLY16 |
C | ILE17 |
C | ASP36 |
C | ARG37 |
C | CYS60 |
C | ASN61 |
C | ILE62 |
C | ASN88 |
C | GLY90 |
C | VAL111 |
C | ILE138 |
C | ALA139 |
C | SER140 |
C | TYR152 |
C | LYS156 |
C | PRO182 |
C | GLY183 |
C | ILE185 |
C | THR187 |
C | THR190 |
C | HOH402 |
site_id | AD1 |
Number of Residues | 3 |
Details | binding site for residue GOL D 301 |
Chain | Residue |
D | ALA14 |
D | ARG15 |
D | HIS40 |
site_id | AD2 |
Number of Residues | 6 |
Details | binding site for residue GOL D 302 |
Chain | Residue |
D | ALA141 |
D | TRP143 |
D | LEU144 |
D | ASN237 |
D | MET242 |
D | LEU244 |
site_id | AD3 |
Number of Residues | 6 |
Details | binding site for residue GOL D 303 |
Chain | Residue |
D | ARG37 |
D | ASN61 |
D | THR107 |
D | ASP110 |
D | HOH415 |
H | HIS40 |
site_id | AD4 |
Number of Residues | 28 |
Details | binding site for residue NAI D 304 |
Chain | Residue |
D | GLY12 |
D | ARG15 |
D | GLY16 |
D | ILE17 |
D | ASP36 |
D | ARG37 |
D | CYS60 |
D | ASN61 |
D | ILE62 |
D | ASN88 |
D | ALA89 |
D | GLY90 |
D | VAL111 |
D | ILE138 |
D | ALA139 |
D | SER140 |
D | TYR152 |
D | LYS156 |
D | PRO182 |
D | GLY183 |
D | ILE185 |
D | THR187 |
D | THR190 |
D | HOH404 |
D | HOH407 |
D | HOH410 |
D | HOH427 |
D | HOH440 |
site_id | AD5 |
Number of Residues | 7 |
Details | binding site for residue GOL E 301 |
Chain | Residue |
E | ALA141 |
E | TRP143 |
E | LEU144 |
E | ASN237 |
E | MET242 |
E | VAL243 |
E | LEU244 |
site_id | AD6 |
Number of Residues | 4 |
Details | binding site for residue GOL E 302 |
Chain | Residue |
E | ALA14 |
E | ARG15 |
E | HIS40 |
E | SER47 |
site_id | AD7 |
Number of Residues | 25 |
Details | binding site for residue NAI E 303 |
Chain | Residue |
E | GLY12 |
E | ALA14 |
E | ARG15 |
E | GLY16 |
E | ILE17 |
E | ASP36 |
E | ARG37 |
E | CYS60 |
E | ASN61 |
E | ILE62 |
E | ASN88 |
E | GLY90 |
E | ILE91 |
E | VAL111 |
E | ILE138 |
E | ALA139 |
E | SER140 |
E | TYR152 |
E | LYS156 |
E | PRO182 |
E | GLY183 |
E | ILE185 |
E | THR187 |
E | THR190 |
E | HOH409 |
site_id | AD8 |
Number of Residues | 5 |
Details | binding site for residue GOL F 301 |
Chain | Residue |
F | ALA141 |
F | TRP143 |
F | ASN237 |
F | MET242 |
F | LEU244 |
site_id | AD9 |
Number of Residues | 1 |
Details | binding site for residue GOL F 302 |
Chain | Residue |
F | LEU144 |
site_id | AE1 |
Number of Residues | 26 |
Details | binding site for residue NAI F 303 |
Chain | Residue |
F | GLY12 |
F | ALA14 |
F | ARG15 |
F | GLY16 |
F | ILE17 |
F | ASP36 |
F | ARG37 |
F | CYS60 |
F | ASN61 |
F | ILE62 |
F | ASN88 |
F | ALA89 |
F | GLY90 |
F | ILE91 |
F | VAL111 |
F | ILE138 |
F | ALA139 |
F | SER140 |
F | TYR152 |
F | LYS156 |
F | PRO182 |
F | GLY183 |
F | ILE185 |
F | THR187 |
F | THR190 |
F | HOH406 |
site_id | AE2 |
Number of Residues | 7 |
Details | binding site for residue GOL G 301 |
Chain | Residue |
G | ALA141 |
G | TRP143 |
G | ASN237 |
G | MET242 |
G | VAL243 |
G | LEU244 |
G | HOH406 |
site_id | AE3 |
Number of Residues | 4 |
Details | binding site for residue GOL G 302 |
Chain | Residue |
G | ALA14 |
G | ARG15 |
G | PHE19 |
G | HIS40 |
site_id | AE4 |
Number of Residues | 1 |
Details | binding site for residue GOL G 303 |
Chain | Residue |
H | ARG229 |
site_id | AE5 |
Number of Residues | 5 |
Details | binding site for residue GOL G 304 |
Chain | Residue |
G | ARG37 |
G | ASN61 |
G | ALA63 |
G | THR107 |
G | ASP110 |
site_id | AE6 |
Number of Residues | 27 |
Details | binding site for residue NAI G 305 |
Chain | Residue |
G | GLY12 |
G | ALA14 |
G | ARG15 |
G | GLY16 |
G | ILE17 |
G | ASP36 |
G | ARG37 |
G | CYS60 |
G | ASN61 |
G | ILE62 |
G | ASN88 |
G | ALA89 |
G | GLY90 |
G | ILE91 |
G | VAL111 |
G | ILE138 |
G | ALA139 |
G | SER140 |
G | TYR152 |
G | LYS156 |
G | PRO182 |
G | GLY183 |
G | ILE185 |
G | THR187 |
G | HOH404 |
G | HOH410 |
G | HOH418 |
site_id | AE7 |
Number of Residues | 3 |
Details | binding site for residue GOL H 301 |
Chain | Residue |
H | ALA14 |
H | HIS40 |
H | SER47 |
site_id | AE8 |
Number of Residues | 6 |
Details | binding site for residue GOL H 302 |
Chain | Residue |
H | ALA141 |
H | TRP143 |
H | ASN237 |
H | MET242 |
H | VAL243 |
H | LEU244 |
site_id | AE9 |
Number of Residues | 29 |
Details | binding site for residue NAI H 304 |
Chain | Residue |
H | GLY12 |
H | ALA14 |
H | ARG15 |
H | GLY16 |
H | ILE17 |
H | ASP36 |
H | ARG37 |
H | CYS60 |
H | ASN61 |
H | ILE62 |
H | ASN88 |
H | ALA89 |
H | GLY90 |
H | VAL111 |
H | ILE138 |
H | ALA139 |
H | SER140 |
H | TYR152 |
H | LYS156 |
H | PRO182 |
H | GLY183 |
H | ILE185 |
H | THR187 |
H | MET189 |
H | THR190 |
H | HOH405 |
H | HOH408 |
H | HOH429 |
H | HOH433 |
Functional Information from PROSITE/UniProt
site_id | PS00061 |
Number of Residues | 29 |
Details | ADH_SHORT Short-chain dehydrogenases/reductases family signature. AsaswlgnvgQtnYSASKAGVvGMTkTAC |
Chain | Residue | Details |
A | ALA139-CYS167 |