Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 4 |
| Details | binding site for residue MG A 601 |
| Chain | Residue |
| A | HIS447 |
| A | HEC612 |
| B | HIS447 |
| B | HEC1009 |
| site_id | AC2 |
| Number of Residues | 2 |
| Details | binding site for residue CL A 602 |
| Chain | Residue |
| A | ASN387 |
| A | TYR403 |
| site_id | AC3 |
| Number of Residues | 5 |
| Details | binding site for residue BU3 A 603 |
| Chain | Residue |
| A | PHE186 |
| A | GLY187 |
| A | GLY68 |
| A | ILE71 |
| A | LYS72 |
| site_id | AC4 |
| Number of Residues | 12 |
| Details | binding site for residue HEC A 604 |
| Chain | Residue |
| A | GLY47 |
| A | ALA50 |
| A | CYS51 |
| A | CYS54 |
| A | HIS55 |
| A | CYS190 |
| A | HIS194 |
| A | HIS200 |
| A | PRO204 |
| A | LYS208 |
| A | MET209 |
| B | GLY371 |
| site_id | AC5 |
| Number of Residues | 15 |
| Details | binding site for residue HEC A 605 |
| Chain | Residue |
| A | LEU111 |
| A | VAL113 |
| A | GLU115 |
| A | VAL132 |
| A | CYS161 |
| A | CYS164 |
| A | HIS165 |
| A | CYS221 |
| A | HIS222 |
| A | GLY238 |
| A | TYR257 |
| A | HIS282 |
| A | GLN284 |
| A | LYS421 |
| A | HEC607 |
| site_id | AC6 |
| Number of Residues | 18 |
| Details | binding site for residue HEC A 606 |
| Chain | Residue |
| A | CYS51 |
| A | HIS55 |
| A | VAL58 |
| A | TRP62 |
| A | HIS67 |
| A | THR189 |
| A | CYS190 |
| A | CYS193 |
| A | HIS194 |
| A | ILE211 |
| A | SER212 |
| A | TYR213 |
| A | GLN339 |
| A | SER344 |
| A | HIS345 |
| A | ARG356 |
| A | HEC607 |
| A | HOH711 |
| site_id | AC7 |
| Number of Residues | 23 |
| Details | binding site for residue HEC A 607 |
| Chain | Residue |
| A | SER66 |
| A | HIS67 |
| A | PHE70 |
| A | LEU105 |
| A | GLY109 |
| A | ALA110 |
| A | LEU111 |
| A | CYS164 |
| A | ILE188 |
| A | GLN192 |
| A | ASN217 |
| A | CYS218 |
| A | GLN220 |
| A | CYS221 |
| A | HIS222 |
| A | GLN339 |
| A | HIS342 |
| A | ALA353 |
| A | PHE354 |
| A | HEC605 |
| A | HEC606 |
| A | HEC609 |
| A | HOH740 |
| site_id | AC8 |
| Number of Residues | 12 |
| Details | binding site for residue HEC A 608 |
| Chain | Residue |
| A | LYS79 |
| A | LEU300 |
| A | ASN303 |
| A | HIS305 |
| A | CYS310 |
| A | CYS313 |
| A | HIS314 |
| A | CYS366 |
| A | HIS367 |
| A | HIS381 |
| A | HEC610 |
| A | HOH712 |
| site_id | AC9 |
| Number of Residues | 16 |
| Details | binding site for residue HEC A 609 |
| Chain | Residue |
| A | LEU355 |
| A | LYS359 |
| A | VAL410 |
| A | LYS421 |
| A | ALA422 |
| A | HIS424 |
| A | HEC607 |
| A | HEC610 |
| A | ALA110 |
| A | HIS222 |
| A | GLN284 |
| A | VAL336 |
| A | THR337 |
| A | CYS338 |
| A | CYS341 |
| A | HIS342 |
| site_id | AD1 |
| Number of Residues | 19 |
| Details | binding site for residue HEC A 610 |
| Chain | Residue |
| A | GLY292 |
| A | HIS293 |
| A | THR295 |
| A | ALA296 |
| A | THR299 |
| A | CYS313 |
| A | HIS314 |
| A | ILE362 |
| A | CYS363 |
| A | GLN365 |
| A | CYS366 |
| A | HIS367 |
| A | HIS413 |
| A | MET414 |
| A | MET426 |
| A | HEC608 |
| A | HEC609 |
| A | HOH732 |
| A | HOH744 |
| site_id | AD2 |
| Number of Residues | 16 |
| Details | binding site for residue HEC A 611 |
| Chain | Residue |
| A | THR364 |
| A | HIS367 |
| A | HIS383 |
| A | ASN387 |
| A | THR408 |
| A | CYS409 |
| A | CYS412 |
| A | HIS413 |
| A | VAL428 |
| A | MET430 |
| A | GLN463 |
| A | SER504 |
| A | VAL507 |
| A | HIS508 |
| A | HEC612 |
| A | HOH725 |
| site_id | AD3 |
| Number of Residues | 20 |
| Details | binding site for residue HEC A 612 |
| Chain | Residue |
| A | VAL401 |
| A | MET402 |
| A | ALA405 |
| A | VAL407 |
| A | SER442 |
| A | CYS443 |
| A | CYS446 |
| A | HIS447 |
| A | VAL458 |
| A | ILE459 |
| A | TRP462 |
| A | MG601 |
| A | HEC611 |
| A | HOH728 |
| A | HOH749 |
| B | HIS447 |
| B | ALA450 |
| B | TYR454 |
| B | HEC1009 |
| B | HOH1102 |
| site_id | AD4 |
| Number of Residues | 16 |
| Details | binding site for Di-peptide HEC B 1001 and CYS B 54 |
| Chain | Residue |
| A | GLY371 |
| B | GLY47 |
| B | ALA50 |
| B | CYS51 |
| B | LYS52 |
| B | THR53 |
| B | HIS55 |
| B | SER56 |
| B | CYS190 |
| B | HIS194 |
| B | HIS200 |
| B | ILE201 |
| B | PRO204 |
| B | LYS208 |
| B | MET209 |
| B | HEC1003 |
| site_id | AD5 |
| Number of Residues | 17 |
| Details | binding site for Di-peptide HEC B 1001 and CYS B 51 |
| Chain | Residue |
| A | GLY371 |
| B | GLY47 |
| B | ASP48 |
| B | GLU49 |
| B | ALA50 |
| B | LYS52 |
| B | THR53 |
| B | CYS54 |
| B | HIS55 |
| B | CYS190 |
| B | HIS194 |
| B | HIS200 |
| B | ILE201 |
| B | PRO204 |
| B | LYS208 |
| B | MET209 |
| B | HEC1003 |
| site_id | AD6 |
| Number of Residues | 19 |
| Details | binding site for Di-peptide HEC B 1002 and CYS B 164 |
| Chain | Residue |
| B | LEU111 |
| B | VAL113 |
| B | GLU115 |
| B | VAL132 |
| B | CYS161 |
| B | ALA162 |
| B | GLY163 |
| B | HIS165 |
| B | ILE188 |
| B | CYS221 |
| B | HIS222 |
| B | SER223 |
| B | GLY238 |
| B | TYR257 |
| B | HIS282 |
| B | GLN284 |
| B | LYS421 |
| B | HEC1004 |
| B | HOH1157 |
| site_id | AD7 |
| Number of Residues | 20 |
| Details | binding site for Di-peptide HEC B 1002 and CYS B 161 |
| Chain | Residue |
| B | LEU111 |
| B | VAL113 |
| B | GLU115 |
| B | VAL132 |
| B | TRP157 |
| B | THR160 |
| B | ALA162 |
| B | GLY163 |
| B | CYS164 |
| B | HIS165 |
| B | CYS221 |
| B | HIS222 |
| B | SER223 |
| B | GLY238 |
| B | TYR257 |
| B | HIS282 |
| B | GLN284 |
| B | LYS421 |
| B | HEC1004 |
| B | HOH1157 |
| site_id | AD8 |
| Number of Residues | 24 |
| Details | binding site for Di-peptide HEC B 1003 and CYS B 193 |
| Chain | Residue |
| B | CYS51 |
| B | HIS55 |
| B | VAL58 |
| B | HIS59 |
| B | TRP62 |
| B | HIS67 |
| B | THR189 |
| B | CYS190 |
| B | GLU191 |
| B | GLN192 |
| B | HIS194 |
| B | ILE211 |
| B | SER212 |
| B | TYR213 |
| B | ASN217 |
| B | PRO249 |
| B | GLN339 |
| B | SER344 |
| B | HIS345 |
| B | ARG356 |
| B | HEC1001 |
| B | HEC1004 |
| B | HOH1130 |
| B | HOH1134 |
| site_id | AD9 |
| Number of Residues | 22 |
| Details | binding site for Di-peptide HEC B 1003 and CYS B 190 |
| Chain | Residue |
| B | CYS51 |
| B | HIS55 |
| B | VAL58 |
| B | HIS59 |
| B | TRP62 |
| B | HIS67 |
| B | THR189 |
| B | GLU191 |
| B | GLN192 |
| B | CYS193 |
| B | HIS194 |
| B | ILE211 |
| B | SER212 |
| B | TYR213 |
| B | GLN339 |
| B | SER344 |
| B | HIS345 |
| B | ARG356 |
| B | HEC1001 |
| B | HEC1004 |
| B | HOH1130 |
| B | HOH1134 |
| site_id | AE1 |
| Number of Residues | 21 |
| Details | binding site for Di-peptide HEC B 1004 and CYS B 221 |
| Chain | Residue |
| B | SER66 |
| B | HIS67 |
| B | PHE70 |
| B | LEU105 |
| B | ALA110 |
| B | LEU111 |
| B | CYS164 |
| B | GLN192 |
| B | ASN217 |
| B | CYS218 |
| B | GLY219 |
| B | GLN220 |
| B | HIS222 |
| B | SER223 |
| B | GLN339 |
| B | HIS342 |
| B | ALA353 |
| B | PHE354 |
| B | HEC1002 |
| B | HEC1003 |
| B | HEC1006 |
| site_id | AE2 |
| Number of Residues | 22 |
| Details | binding site for Di-peptide HEC B 1004 and CYS B 218 |
| Chain | Residue |
| B | SER66 |
| B | HIS67 |
| B | PHE70 |
| B | LEU105 |
| B | ALA110 |
| B | LEU111 |
| B | CYS164 |
| B | GLN192 |
| B | ALA215 |
| B | GLU216 |
| B | ASN217 |
| B | GLY219 |
| B | GLN220 |
| B | CYS221 |
| B | HIS222 |
| B | GLN339 |
| B | HIS342 |
| B | ALA353 |
| B | PHE354 |
| B | HEC1002 |
| B | HEC1003 |
| B | HEC1006 |
| site_id | AE3 |
| Number of Residues | 16 |
| Details | binding site for Di-peptide HEC B 1005 and CYS B 313 |
| Chain | Residue |
| B | THR299 |
| B | LEU300 |
| B | ASN303 |
| B | HIS305 |
| B | CYS310 |
| B | LEU311 |
| B | LYS312 |
| B | HIS314 |
| B | VAL336 |
| B | CYS366 |
| B | HIS367 |
| B | HIS381 |
| B | HIS383 |
| B | HEC1007 |
| B | HOH1104 |
| B | HOH1153 |
| site_id | AE4 |
| Number of Residues | 18 |
| Details | binding site for Di-peptide HEC B 1005 and CYS B 310 |
| Chain | Residue |
| B | THR299 |
| B | LEU300 |
| B | ASN303 |
| B | HIS305 |
| B | GLN307 |
| B | ASP308 |
| B | ARG309 |
| B | LEU311 |
| B | LYS312 |
| B | CYS313 |
| B | HIS314 |
| B | CYS366 |
| B | HIS367 |
| B | HIS381 |
| B | HIS383 |
| B | HEC1007 |
| B | HOH1104 |
| B | HOH1153 |
| site_id | AE5 |
| Number of Residues | 21 |
| Details | binding site for Di-peptide HEC B 1006 and CYS B 341 |
| Chain | Residue |
| B | LEU111 |
| B | HIS222 |
| B | GLN284 |
| B | TYR285 |
| B | TRP288 |
| B | THR337 |
| B | CYS338 |
| B | GLN339 |
| B | VAL340 |
| B | HIS342 |
| B | LEU355 |
| B | ARG356 |
| B | LYS359 |
| B | ILE362 |
| B | VAL410 |
| B | LYS421 |
| B | ALA422 |
| B | HIS424 |
| B | HEC1004 |
| B | HEC1007 |
| B | HOH1121 |
| site_id | AE6 |
| Number of Residues | 19 |
| Details | binding site for Di-peptide HEC B 1006 and CYS B 338 |
| Chain | Residue |
| B | LEU111 |
| B | HIS222 |
| B | GLN284 |
| B | TYR285 |
| B | TRP288 |
| B | THR337 |
| B | GLN339 |
| B | VAL340 |
| B | CYS341 |
| B | HIS342 |
| B | LEU355 |
| B | LYS359 |
| B | VAL410 |
| B | LYS421 |
| B | ALA422 |
| B | HIS424 |
| B | HEC1004 |
| B | HEC1007 |
| B | HOH1121 |
| site_id | AE7 |
| Number of Residues | 20 |
| Details | binding site for Di-peptide HEC B 1007 and CYS B 366 |
| Chain | Residue |
| B | GLY292 |
| B | HIS293 |
| B | THR295 |
| B | ALA296 |
| B | THR299 |
| B | CYS313 |
| B | HIS314 |
| B | VAL340 |
| B | ILE362 |
| B | CYS363 |
| B | THR364 |
| B | GLN365 |
| B | HIS367 |
| B | ASN368 |
| B | HIS413 |
| B | MET426 |
| B | HEC1005 |
| B | HEC1006 |
| B | HOH1104 |
| B | HOH1169 |
| site_id | AE8 |
| Number of Residues | 21 |
| Details | binding site for Di-peptide HEC B 1007 and CYS B 363 |
| Chain | Residue |
| B | GLY292 |
| B | HIS293 |
| B | THR295 |
| B | ALA296 |
| B | THR299 |
| B | CYS313 |
| B | HIS314 |
| B | VAL340 |
| B | GLU361 |
| B | ILE362 |
| B | THR364 |
| B | GLN365 |
| B | CYS366 |
| B | HIS367 |
| B | HIS413 |
| B | MET426 |
| B | HEC1005 |
| B | HEC1006 |
| B | HOH1104 |
| B | HOH1142 |
| B | HOH1169 |
| site_id | AE9 |
| Number of Residues | 18 |
| Details | binding site for Di-peptide HEC B 1008 and CYS B 412 |
| Chain | Residue |
| B | THR364 |
| B | HIS367 |
| B | HIS383 |
| B | ASN387 |
| B | CYS409 |
| B | VAL410 |
| B | ASP411 |
| B | HIS413 |
| B | MET414 |
| B | PRO415 |
| B | VAL428 |
| B | MET430 |
| B | SER442 |
| B | GLN463 |
| B | SER504 |
| B | HIS508 |
| B | HEC1009 |
| B | HOH1137 |
| site_id | AF1 |
| Number of Residues | 16 |
| Details | binding site for Di-peptide HEC B 1008 and CYS B 409 |
| Chain | Residue |
| B | THR364 |
| B | HIS367 |
| B | HIS383 |
| B | ASN387 |
| B | THR408 |
| B | VAL410 |
| B | ASP411 |
| B | CYS412 |
| B | HIS413 |
| B | VAL428 |
| B | MET430 |
| B | GLN463 |
| B | SER504 |
| B | HIS508 |
| B | HEC1009 |
| B | HOH1137 |
| site_id | AF2 |
| Number of Residues | 25 |
| Details | binding site for Di-peptide HEC B 1009 and CYS B 446 |
| Chain | Residue |
| A | HIS447 |
| A | PRO448 |
| A | GLY449 |
| A | ALA450 |
| A | TYR454 |
| A | MG601 |
| A | HEC612 |
| B | VAL401 |
| B | MET402 |
| B | ALA405 |
| B | VAL407 |
| B | ASP411 |
| B | SER442 |
| B | CYS443 |
| B | SER444 |
| B | SER445 |
| B | HIS447 |
| B | PRO448 |
| B | VAL458 |
| B | ILE459 |
| B | HEC1008 |
| B | HOH1102 |
| B | HOH1117 |
| B | HOH1136 |
| B | HOH1151 |
| site_id | AF3 |
| Number of Residues | 23 |
| Details | binding site for Di-peptide HEC B 1009 and CYS B 443 |
| Chain | Residue |
| A | HIS447 |
| A | GLY449 |
| A | ALA450 |
| A | TYR454 |
| A | MG601 |
| A | HEC612 |
| B | VAL401 |
| B | MET402 |
| B | ALA405 |
| B | VAL407 |
| B | ASP411 |
| B | ASP441 |
| B | SER442 |
| B | SER444 |
| B | SER445 |
| B | CYS446 |
| B | HIS447 |
| B | VAL458 |
| B | ILE459 |
| B | HEC1008 |
| B | HOH1102 |
| B | HOH1117 |
| B | HOH1136 |
