Table II.
N = 100; R = 2.5; D = 2.5a | ||||
---|---|---|---|---|
PDB code | Catalytic residues | Number of matches | Rankb | RMSD (Å)c |
1c2t | Asn, His, Asp | 41 | 1 | 0.7 |
1dqx | Lys, Asp, Lys, Asp | 2583 | 31 | 1.8 |
1h2j | Glu, Glu | 150 | 14 | 3.6 |
1jcl | Lys, Asp, Lys | 62 | 9 | 1.8 |
1ney | Lys, His, Glu | 420 | 2 | 1.4 |
1oex | Asp, Asp | 65 | 8 | 1.1 |
1p6o | His, Cys, Cys, Glu | 12 | 1 | 1.7 |
3vgc | Ser, His, Asp | 88 | 1 | 1.3 |
4fua | His, His, His | 176 | 1 | 1.1 |
6cpa | His, Glu, His, Glu | 685 | 66 | 1.2 |
The catalytic geometry parameters are obtained from Ref.16.
All parameters are set to the optimal values.
Rank of native match.
RMSD of the TS and the catalytic residues.