Table 2.
PME-PMEI Intermolecular Contacts
| Enzyme Residues | Inhibitor Residues | Number of Contacts |
|---|---|---|
| Ser50 | Asp83 | 3 |
| Thr78 | Thr73 Arg70 Gly69 | 8 |
| Phe80 | Thr73 Glu76 Asn77 Thr113 | 17 |
| Arg81 | Gly69 Glu72 Thr73 Glu76 | 13 |
| Val88 | Asp80 | 1 |
| Gln90 | Glu87 Tyr103 | 3 |
| Asp118 | Ile102 Tyr103 | 9 |
| Tyr135 | Thr113 | 1 |
| His137 | Asn77 Thr113 | 7 |
| Ser138 | Ala106 | 2 |
| Gln139 | Ser84 Ile102 Tyr103 Ala106 | 14 |
| Arg140 | Ser99 Ile102 Tyr103 | 13 |
| Asn158 | Asp109 | 6 |
| Ala160 | Ile102 | 1 |
| Thr187 | Arg13 Phe108 | 4 |
| Asp188 | Phe108 Asp140 Leu143 | 11 |
| Asn190 | Lys11 Asn101 Asp140 Leu143 Val144 Asn147 | 20 |
| Gln191 | Asn101 Ser105 Phe108 Asp109 Leu143 | 18 |
| Ala192 | Asn101 Ile102 Ser105 | 8 |
| Thr193 | Ser105 | 1 |
| Trp223 | Asp116 | 3 |
| Lys224 | Asp116 | 5 |
| Gln299 | Asn98 | 8 |
The number of atom–atom contacts at a distance of below 4.1 Å have been identified using the program Contact (CCP4).