3MAX
Crystal Structure of Human HDAC2 complexed with an N-(2-aminophenyl)benzamide
Functional Information from GO Data
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ZN A 379 |
| Chain | Residue |
| A | ASP181 |
| A | HIS183 |
| A | ASP269 |
| A | LLX400 |
| site_id | AC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CA A 380 |
| Chain | Residue |
| A | ASP179 |
| A | ASP181 |
| A | HIS183 |
| A | SER202 |
| A | PHE203 |
| site_id | AC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NA A 381 |
| Chain | Residue |
| A | PHE192 |
| A | THR195 |
| A | VAL198 |
| A | TYR227 |
| A | HOH396 |
| A | HOH425 |
| site_id | AC4 |
| Number of Residues | 19 |
| Details | BINDING SITE FOR RESIDUE LLX A 400 |
| Chain | Residue |
| A | TYR29 |
| A | MET35 |
| A | ARG39 |
| A | GLY143 |
| A | LEU144 |
| A | HIS145 |
| A | HIS146 |
| A | GLY154 |
| A | PHE155 |
| A | CYS156 |
| A | ASP181 |
| A | HIS183 |
| A | PHE210 |
| A | ASP269 |
| A | LEU276 |
| A | GLY305 |
| A | GLY306 |
| A | TYR308 |
| A | ZN379 |
| site_id | AC5 |
| Number of Residues | 11 |
| Details | BINDING SITE FOR RESIDUE NHE A 383 |
| Chain | Residue |
| A | TYR59 |
| A | LYS128 |
| A | HOH537 |
| A | HOH538 |
| A | HOH539 |
| B | ASP21 |
| B | GLY22 |
| B | ASP23 |
| B | ARG60 |
| B | GLU113 |
| B | LEU117 |
| site_id | AC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ZN B 379 |
| Chain | Residue |
| B | ASP181 |
| B | HIS183 |
| B | ASP269 |
| B | LLX400 |
| site_id | AC7 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CA B 380 |
| Chain | Residue |
| B | ASP179 |
| B | ASP181 |
| B | HIS183 |
| B | SER202 |
| B | PHE203 |
| site_id | AC8 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NA B 381 |
| Chain | Residue |
| B | PHE192 |
| B | THR195 |
| B | VAL198 |
| B | TYR227 |
| B | HOH385 |
| B | HOH441 |
| site_id | AC9 |
| Number of Residues | 18 |
| Details | BINDING SITE FOR RESIDUE LLX B 400 |
| Chain | Residue |
| B | TYR29 |
| B | MET35 |
| B | ARG39 |
| B | GLY143 |
| B | LEU144 |
| B | HIS145 |
| B | HIS146 |
| B | GLY154 |
| B | PHE155 |
| B | CYS156 |
| B | ASP181 |
| B | HIS183 |
| B | PHE210 |
| B | ASP269 |
| B | GLY305 |
| B | GLY306 |
| B | TYR308 |
| B | ZN379 |
| site_id | BC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ZN C 379 |
| Chain | Residue |
| C | ASP181 |
| C | HIS183 |
| C | ASP269 |
| C | LLX400 |
| site_id | BC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CA C 380 |
| Chain | Residue |
| C | ASP179 |
| C | ASP181 |
| C | HIS183 |
| C | SER202 |
| C | PHE203 |
| site_id | BC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NA C 381 |
| Chain | Residue |
| C | PHE192 |
| C | THR195 |
| C | VAL198 |
| C | TYR227 |
| C | HOH389 |
| C | HOH464 |
| site_id | BC4 |
| Number of Residues | 19 |
| Details | BINDING SITE FOR RESIDUE LLX C 400 |
| Chain | Residue |
| C | HIS146 |
| C | GLY154 |
| C | PHE155 |
| C | CYS156 |
| C | ASP181 |
| C | HIS183 |
| C | PHE210 |
| C | ASP269 |
| C | LEU276 |
| C | GLY305 |
| C | GLY306 |
| C | TYR308 |
| C | ZN379 |
| C | TYR29 |
| C | MET35 |
| C | ARG39 |
| C | GLY143 |
| C | LEU144 |
| C | HIS145 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 626 |
| Details | Region: {"description":"Histone deacetylase"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 3 |
| Details | Active site: {"evidences":[{"source":"UniProtKB","id":"Q13547","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 9 |
| Details | Binding site: {"evidences":[{"source":"UniProtKB","id":"O15379","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 27 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"37137925","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"8BPA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"8BPB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"8BPC","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI5 |
| Number of Residues | 3 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"37137925","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"8BPB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"8BPC","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI6 |
| Number of Residues | 3 |
| Details | Modified residue: {"description":"N6-acetyllysine; alternate","evidences":[{"source":"UniProtKB","id":"Q13547","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI7 |
| Number of Residues | 3 |
| Details | Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"UniProtKB","id":"Q13547","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI8 |
| Number of Residues | 6 |
| Details | Modified residue: {"description":"S-nitrosocysteine","evidences":[{"source":"UniProtKB","id":"P70288","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI9 |
| Number of Residues | 6 |
| Details | Cross-link: {"description":"Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO2); alternate","evidences":[{"source":"PubMed","id":"28112733","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
