1PT9
Crystal Structure Analysis of the DIII Component of Transhydrogenase with a Thio-Nicotinamide Nucleotide Analogue
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 A 208 |
| Chain | Residue |
| A | ARG164 |
| A | HOH356 |
| A | HOH363 |
| site_id | AC2 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SO4 B 210 |
| Chain | Residue |
| B | ARG164 |
| B | HOH338 |
| B | HOH362 |
| site_id | AC3 |
| Number of Residues | 30 |
| Details | BINDING SITE FOR RESIDUE TAP A 300 |
| Chain | Residue |
| A | VAL86 |
| A | ALA87 |
| A | GLY88 |
| A | ARG89 |
| A | MET90 |
| A | PRO91 |
| A | GLY128 |
| A | ALA129 |
| A | ASN130 |
| A | ASP131 |
| A | THR132 |
| A | ALA146 |
| A | GLY147 |
| A | LYS163 |
| A | ARG164 |
| A | SER165 |
| A | VAL168 |
| A | GLY169 |
| A | TYR170 |
| A | ASP189 |
| A | ALA190 |
| A | GOL220 |
| A | HOH305 |
| A | HOH328 |
| A | HOH332 |
| A | HOH385 |
| A | HOH386 |
| A | GLY53 |
| A | TYR54 |
| A | GLY55 |
| site_id | AC4 |
| Number of Residues | 29 |
| Details | BINDING SITE FOR RESIDUE TAP B 301 |
| Chain | Residue |
| B | GLY53 |
| B | TYR54 |
| B | GLY55 |
| B | ALA59 |
| B | VAL86 |
| B | ALA87 |
| B | GLY88 |
| B | ARG89 |
| B | MET90 |
| B | PRO91 |
| B | GLY128 |
| B | ALA129 |
| B | ASN130 |
| B | ASP131 |
| B | THR132 |
| B | LYS163 |
| B | ARG164 |
| B | SER165 |
| B | VAL168 |
| B | GLY169 |
| B | TYR170 |
| B | ASP189 |
| B | ALA190 |
| B | GOL230 |
| B | HOH305 |
| B | HOH312 |
| B | HOH338 |
| B | HOH348 |
| B | HOH371 |
| site_id | AC5 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE GOL A 220 |
| Chain | Residue |
| A | HIS84 |
| A | VAL86 |
| A | ASP131 |
| A | MET148 |
| A | PRO149 |
| A | VAL150 |
| A | TAP300 |
| A | HOH376 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE GOL B 230 |
| Chain | Residue |
| B | HIS84 |
| B | VAL86 |
| B | ASP131 |
| B | MET148 |
| B | VAL150 |
| B | TAP301 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 36 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"10673423","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12791694","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15323555","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1DJL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PT9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1U31","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 2 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"10673423","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15323555","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1DJL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1U31","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 2 |
| Details | Modified residue: {"description":"N6-succinyllysine","evidences":[{"source":"UniProtKB","id":"Q61941","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
Catalytic Information from CSA
| site_id | CSA1 |
| Number of Residues | 3 |
| Details | Annotated By Reference To The Literature 1djl |
| Chain | Residue | Details |
| A | TYR54 | |
| A | TYR170 | |
| A | ARG89 |
| site_id | CSA2 |
| Number of Residues | 3 |
| Details | Annotated By Reference To The Literature 1djl |
| Chain | Residue | Details |
| B | TYR54 | |
| B | TYR170 | |
| B | ARG89 |
| site_id | MCSA1 |
| Number of Residues | 3 |
| Details | M-CSA 496 |
| Chain | Residue | Details |
| A | TYR54 | electrostatic stabiliser |
| A | ARG89 | electrostatic stabiliser |
| A | TYR170 | electrostatic stabiliser |
| site_id | MCSA2 |
| Number of Residues | 3 |
| Details | M-CSA 496 |
| Chain | Residue | Details |
| B | TYR54 | electrostatic stabiliser |
| B | ARG89 | electrostatic stabiliser |
| B | TYR170 | electrostatic stabiliser |
