4GF5
Crystal Structure of Calicheamicin Methyltransferase, CalS11
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0008171 | molecular_function | O-methyltransferase activity |
| B | 0008171 | molecular_function | O-methyltransferase activity |
| C | 0008171 | molecular_function | O-methyltransferase activity |
| D | 0008171 | molecular_function | O-methyltransferase activity |
| E | 0008171 | molecular_function | O-methyltransferase activity |
| F | 0008171 | molecular_function | O-methyltransferase activity |
| G | 0008171 | molecular_function | O-methyltransferase activity |
| H | 0008171 | molecular_function | O-methyltransferase activity |
| I | 0008171 | molecular_function | O-methyltransferase activity |
| J | 0008171 | molecular_function | O-methyltransferase activity |
| K | 0008171 | molecular_function | O-methyltransferase activity |
| L | 0008171 | molecular_function | O-methyltransferase activity |
| M | 0008171 | molecular_function | O-methyltransferase activity |
| N | 0008171 | molecular_function | O-methyltransferase activity |
| O | 0008171 | molecular_function | O-methyltransferase activity |
| P | 0008171 | molecular_function | O-methyltransferase activity |
| Q | 0008171 | molecular_function | O-methyltransferase activity |
| R | 0008171 | molecular_function | O-methyltransferase activity |
| S | 0008171 | molecular_function | O-methyltransferase activity |
| T | 0008171 | molecular_function | O-methyltransferase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 20 |
| Details | BINDING SITE FOR RESIDUE SAH A 301 |
| Chain | Residue |
| A | GLU75 |
| A | PHE112 |
| A | PRO113 |
| A | GLY165 |
| A | ASP166 |
| A | VAL167 |
| A | ASP189 |
| A | LEU190 |
| A | PRO195 |
| A | HOH405 |
| A | HOH410 |
| A | GLY77 |
| A | HOH439 |
| A | VAL78 |
| A | ARG79 |
| A | ARG82 |
| A | HIS83 |
| A | ASP107 |
| A | THR108 |
| A | GLY111 |
| site_id | AC2 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 A 302 |
| Chain | Residue |
| A | HIS51 |
| A | ARG82 |
| A | HOH475 |
| site_id | AC3 |
| Number of Residues | 19 |
| Details | BINDING SITE FOR RESIDUE SAH C 301 |
| Chain | Residue |
| C | GLU75 |
| C | GLY77 |
| C | VAL78 |
| C | ARG79 |
| C | ARG82 |
| C | HIS83 |
| C | ASP107 |
| C | THR108 |
| C | GLY111 |
| C | PHE112 |
| C | PRO113 |
| C | GLY165 |
| C | ASP166 |
| C | VAL167 |
| C | ASP189 |
| C | LEU190 |
| C | PRO195 |
| G | HOH403 |
| G | HOH410 |
| site_id | AC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE SO4 C 302 |
| Chain | Residue |
| C | HIS51 |
| C | ARG82 |
| C | HOH496 |
| C | HOH513 |
| C | HOH518 |
| site_id | AC5 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH E 301 |
| Chain | Residue |
| E | GLU75 |
| E | GLY77 |
| E | VAL78 |
| E | ARG79 |
| E | ARG82 |
| E | HIS83 |
| E | ASP107 |
| E | THR108 |
| E | GLY111 |
| E | PRO113 |
| E | GLY165 |
| E | ASP166 |
| E | VAL167 |
| E | ASP189 |
| E | LEU190 |
| E | PRO195 |
| E | HOH422 |
| E | HOH445 |
| E | HOH458 |
| E | HOH474 |
| E | HOH484 |
| site_id | AC6 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 E 302 |
| Chain | Residue |
| E | HIS51 |
| E | ARG82 |
| site_id | AC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 E 303 |
| Chain | Residue |
| E | THR124 |
| E | ARG129 |
| E | LYS222 |
| E | TRP223 |
| site_id | AC8 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH F 301 |
| Chain | Residue |
| F | GLU75 |
| F | GLY77 |
| F | VAL78 |
| F | ARG79 |
| F | ARG82 |
| F | HIS83 |
| F | ASP107 |
| F | THR108 |
| F | GLY111 |
| F | PHE112 |
| F | PRO113 |
| F | GLY165 |
| F | ASP166 |
| F | VAL167 |
| F | ASP189 |
| F | LEU190 |
| F | PRO195 |
| F | HOH451 |
| F | HOH497 |
| I | HOH415 |
| I | HOH444 |
| site_id | AC9 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 F 302 |
| Chain | Residue |
| F | HIS51 |
| F | ARG82 |
| site_id | BC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 F 303 |
| Chain | Residue |
| F | LYS222 |
| F | TRP223 |
| F | THR124 |
| F | ARG129 |
| site_id | BC2 |
| Number of Residues | 19 |
| Details | BINDING SITE FOR RESIDUE SAH H 301 |
| Chain | Residue |
| B | HOH404 |
| H | GLU75 |
| H | GLY77 |
| H | VAL78 |
| H | ARG79 |
| H | ARG82 |
| H | HIS83 |
| H | ASP107 |
| H | THR108 |
| H | GLY111 |
| H | PHE112 |
| H | PRO113 |
| H | GLY165 |
| H | ASP166 |
| H | VAL167 |
| H | ASP189 |
| H | LEU190 |
| H | PRO195 |
| H | HOH476 |
| site_id | BC3 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 H 302 |
| Chain | Residue |
| H | HIS51 |
| H | ARG82 |
| site_id | BC4 |
| Number of Residues | 20 |
| Details | BINDING SITE FOR RESIDUE SAH B 301 |
| Chain | Residue |
| B | GLU75 |
| B | GLY77 |
| B | VAL78 |
| B | ARG79 |
| B | ARG82 |
| B | HIS83 |
| B | ASP107 |
| B | THR108 |
| B | GLY111 |
| B | PHE112 |
| B | PRO113 |
| B | GLY165 |
| B | ASP166 |
| B | VAL167 |
| B | ASP189 |
| B | LEU190 |
| B | PRO195 |
| B | HOH484 |
| B | HOH507 |
| H | HOH414 |
| site_id | BC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 B 302 |
| Chain | Residue |
| B | HIS51 |
| B | GLN52 |
| B | ARG82 |
| B | HOH526 |
| site_id | BC6 |
| Number of Residues | 18 |
| Details | BINDING SITE FOR RESIDUE SAH D 301 |
| Chain | Residue |
| D | GLU75 |
| D | GLY77 |
| D | VAL78 |
| D | ARG79 |
| D | ARG82 |
| D | HIS83 |
| D | ASP107 |
| D | THR108 |
| D | GLY111 |
| D | PHE112 |
| D | PRO113 |
| D | GLY165 |
| D | ASP166 |
| D | VAL167 |
| D | ASP189 |
| D | LEU190 |
| D | PRO195 |
| E | HOH526 |
| site_id | BC7 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 D 302 |
| Chain | Residue |
| D | HIS51 |
| D | ARG82 |
| D | HOH519 |
| site_id | BC8 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH G 301 |
| Chain | Residue |
| G | GLU75 |
| G | GLY77 |
| G | VAL78 |
| G | ARG79 |
| G | ARG82 |
| G | HIS83 |
| G | ASP107 |
| G | THR108 |
| G | GLY111 |
| G | PHE112 |
| G | PRO113 |
| G | PHE130 |
| G | GLY165 |
| G | ASP166 |
| G | VAL167 |
| G | ASP189 |
| G | LEU190 |
| G | PRO195 |
| G | HOH413 |
| G | HOH486 |
| G | HOH512 |
| site_id | BC9 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 G 302 |
| Chain | Residue |
| G | HIS51 |
| G | ARG82 |
| site_id | CC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 G 303 |
| Chain | Residue |
| G | ARG120 |
| G | TYR126 |
| G | GLN127 |
| L | ARG129 |
| site_id | CC2 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH I 301 |
| Chain | Residue |
| F | HOH405 |
| I | GLY77 |
| I | VAL78 |
| I | ARG79 |
| I | ARG82 |
| I | HIS83 |
| I | ASP107 |
| I | THR108 |
| I | GLY111 |
| I | PHE112 |
| I | PRO113 |
| I | GLY165 |
| I | ASP166 |
| I | VAL167 |
| I | ASP189 |
| I | LEU190 |
| I | PRO195 |
| I | HOH409 |
| I | HOH427 |
| I | HOH451 |
| I | HOH470 |
| site_id | CC3 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 I 302 |
| Chain | Residue |
| I | HIS51 |
| I | ARG82 |
| I | HOH526 |
| site_id | CC4 |
| Number of Residues | 20 |
| Details | BINDING SITE FOR RESIDUE SAH J 301 |
| Chain | Residue |
| A | HOH408 |
| J | GLU75 |
| J | GLY77 |
| J | VAL78 |
| J | ARG79 |
| J | ARG82 |
| J | HIS83 |
| J | ASP107 |
| J | THR108 |
| J | GLY111 |
| J | PHE112 |
| J | PRO113 |
| J | GLY165 |
| J | ASP166 |
| J | VAL167 |
| J | ASP189 |
| J | LEU190 |
| J | PRO195 |
| J | HOH419 |
| J | HOH465 |
| site_id | CC5 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 J 302 |
| Chain | Residue |
| J | HIS51 |
| J | ARG82 |
| J | HOH436 |
| site_id | CC6 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 J 303 |
| Chain | Residue |
| A | ARG64 |
| J | ARG64 |
| J | HOH544 |
| site_id | CC7 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH K 301 |
| Chain | Residue |
| K | GLU75 |
| K | GLY77 |
| K | VAL78 |
| K | ARG79 |
| K | ARG82 |
| K | HIS83 |
| K | ASP107 |
| K | THR108 |
| K | GLY111 |
| K | PHE112 |
| K | PRO113 |
| K | GLY165 |
| K | ASP166 |
| K | VAL167 |
| K | ASP189 |
| K | LEU190 |
| K | PRO195 |
| K | HOH422 |
| K | HOH471 |
| Q | HOH420 |
| Q | HOH431 |
| site_id | CC8 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 K 302 |
| Chain | Residue |
| K | HIS51 |
| K | GLN52 |
| K | ARG82 |
| site_id | CC9 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 K 303 |
| Chain | Residue |
| K | THR124 |
| K | PHE130 |
| K | LYS222 |
| site_id | DC1 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH L 301 |
| Chain | Residue |
| L | GLU75 |
| L | GLY77 |
| L | VAL78 |
| L | ARG79 |
| L | ARG82 |
| L | HIS83 |
| L | ASP107 |
| L | THR108 |
| L | GLY111 |
| L | PHE112 |
| L | PRO113 |
| L | GLY165 |
| L | ASP166 |
| L | VAL167 |
| L | ASP189 |
| L | LEU190 |
| L | PRO195 |
| L | HOH458 |
| L | HOH524 |
| P | HOH413 |
| P | HOH487 |
| site_id | DC2 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 L 302 |
| Chain | Residue |
| L | HIS51 |
| L | ARG82 |
| site_id | DC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE SO4 L 303 |
| Chain | Residue |
| L | THR124 |
| L | ARG129 |
| L | PHE130 |
| L | LYS222 |
| L | TRP223 |
| L | HOH489 |
| site_id | DC4 |
| Number of Residues | 18 |
| Details | BINDING SITE FOR RESIDUE SAH M 301 |
| Chain | Residue |
| M | GLU75 |
| M | GLY77 |
| M | VAL78 |
| M | ARG79 |
| M | ARG82 |
| M | HIS83 |
| M | ASP107 |
| M | THR108 |
| M | GLY111 |
| M | PHE112 |
| M | PRO113 |
| M | GLY165 |
| M | ASP166 |
| M | VAL167 |
| M | ASP189 |
| M | LEU190 |
| M | PRO195 |
| R | HOH425 |
| site_id | DC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 M 302 |
| Chain | Residue |
| M | THR124 |
| M | PHE130 |
| M | LYS222 |
| M | TRP223 |
| site_id | DC6 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 M 303 |
| Chain | Residue |
| M | HIS51 |
| M | ARG82 |
| M | HOH493 |
| site_id | DC7 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH N 301 |
| Chain | Residue |
| N | GLU75 |
| N | GLY77 |
| N | ARG79 |
| N | ARG82 |
| N | HIS83 |
| N | ASP107 |
| N | THR108 |
| N | GLY111 |
| N | PHE112 |
| N | PRO113 |
| N | GLY165 |
| N | ASP166 |
| N | VAL167 |
| N | ASP189 |
| N | LEU190 |
| N | ASP191 |
| N | PRO195 |
| N | HOH433 |
| N | HOH475 |
| N | HOH488 |
| T | HOH407 |
| site_id | DC8 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 N 302 |
| Chain | Residue |
| N | HIS51 |
| N | ARG82 |
| site_id | DC9 |
| Number of Residues | 19 |
| Details | BINDING SITE FOR RESIDUE SAH O 301 |
| Chain | Residue |
| O | GLU75 |
| O | GLY77 |
| O | VAL78 |
| O | ARG79 |
| O | ARG82 |
| O | HIS83 |
| O | ASP107 |
| O | THR108 |
| O | GLY111 |
| O | PHE112 |
| O | PRO113 |
| O | GLY165 |
| O | ASP166 |
| O | VAL167 |
| O | ASP189 |
| O | LEU190 |
| O | PRO195 |
| O | HOH461 |
| S | HOH412 |
| site_id | EC1 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 O 302 |
| Chain | Residue |
| O | HIS51 |
| O | ARG82 |
| O | HOH440 |
| site_id | EC2 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH P 301 |
| Chain | Residue |
| L | HOH424 |
| L | HOH435 |
| P | GLU75 |
| P | GLY77 |
| P | VAL78 |
| P | ARG79 |
| P | ARG82 |
| P | HIS83 |
| P | ASP107 |
| P | THR108 |
| P | GLY111 |
| P | PHE112 |
| P | PRO113 |
| P | GLY165 |
| P | ASP166 |
| P | VAL167 |
| P | ASP189 |
| P | LEU190 |
| P | PRO195 |
| P | HOH428 |
| P | HOH524 |
| site_id | EC3 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 P 302 |
| Chain | Residue |
| P | HIS51 |
| P | ARG82 |
| site_id | EC4 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE SAH Q 301 |
| Chain | Residue |
| K | HOH403 |
| Q | GLU75 |
| Q | GLY77 |
| Q | VAL78 |
| Q | ARG79 |
| Q | ARG82 |
| Q | HIS83 |
| Q | ASP107 |
| Q | THR108 |
| Q | GLY111 |
| Q | PHE112 |
| Q | PRO113 |
| Q | GLY165 |
| Q | ASP166 |
| Q | VAL167 |
| Q | ASP189 |
| Q | LEU190 |
| Q | PRO195 |
| Q | HOH418 |
| Q | HOH442 |
| Q | HOH516 |
| site_id | EC5 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 Q 302 |
| Chain | Residue |
| Q | HIS51 |
| Q | ARG82 |
| site_id | EC6 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE SAH R 301 |
| Chain | Residue |
| M | HOH415 |
| R | GLU75 |
| R | GLY77 |
| R | VAL78 |
| R | ARG79 |
| R | ARG82 |
| R | HIS83 |
| R | ASP107 |
| R | THR108 |
| R | GLY111 |
| R | PHE112 |
| R | PRO113 |
| R | GLY165 |
| R | ASP166 |
| R | VAL167 |
| R | ASP189 |
| R | LEU190 |
| R | LEU192 |
| R | PRO195 |
| R | HOH421 |
| R | HOH434 |
| R | HOH478 |
| site_id | EC7 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 R 302 |
| Chain | Residue |
| R | HIS51 |
| R | ARG82 |
| site_id | EC8 |
| Number of Residues | 18 |
| Details | BINDING SITE FOR RESIDUE SAH S 301 |
| Chain | Residue |
| S | GLU75 |
| S | GLY77 |
| S | ARG79 |
| S | ARG82 |
| S | HIS83 |
| S | ASP107 |
| S | THR108 |
| S | GLY111 |
| S | PHE112 |
| S | PRO113 |
| S | GLY165 |
| S | ASP166 |
| S | VAL167 |
| S | ASP189 |
| S | LEU190 |
| S | PRO195 |
| S | HOH404 |
| S | HOH447 |
| site_id | EC9 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE SO4 S 302 |
| Chain | Residue |
| S | HIS51 |
| S | ARG82 |
| site_id | FC1 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 S 303 |
| Chain | Residue |
| E | HOH487 |
| S | ARG129 |
| S | PHE130 |
| site_id | FC2 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE SAH T 301 |
| Chain | Residue |
| T | GLU75 |
| T | GLY77 |
| T | VAL78 |
| T | ARG79 |
| T | ARG82 |
| T | HIS83 |
| T | ASP107 |
| T | THR108 |
| T | GLY111 |
| T | PHE112 |
| T | PRO113 |
| T | GLY165 |
| T | ASP166 |
| T | VAL167 |
| T | ASP189 |
| T | LEU190 |
| T | PRO195 |
| site_id | FC3 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 T 302 |
| Chain | Residue |
| T | HIS51 |
| T | ARG82 |
| T | HOH481 |
