4KP6
Crystal structure of human phosphodiesterase 4B (PDE4B) in complex with a [1,3,5]triazine derivative
Functional Information from GO Data
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 11 |
Details | BINDING SITE FOR RESIDUE 1S1 A 501 |
Chain | Residue |
A | HIS234 |
A | HOH635 |
A | HOH646 |
A | MET347 |
A | ASN395 |
A | THR407 |
A | ILE410 |
A | MET431 |
A | SER442 |
A | GLN443 |
A | PHE446 |
site_id | AC2 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE MG A 502 |
Chain | Residue |
A | ASP275 |
A | HOH612 |
A | HOH613 |
A | HOH709 |
A | HOH712 |
A | HOH726 |
site_id | AC3 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE ZN A 503 |
Chain | Residue |
A | HIS238 |
A | HIS274 |
A | ASP275 |
A | ASP392 |
A | HOH711 |
A | HOH712 |
site_id | AC4 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE EDO A 504 |
Chain | Residue |
A | THR208 |
A | PHE209 |
A | ASN325 |
A | LEU326 |
A | GLN330 |
A | EDO521 |
site_id | AC5 |
Number of Residues | 10 |
Details | BINDING SITE FOR RESIDUE EDO A 505 |
Chain | Residue |
A | ARG210 |
A | ILE211 |
A | SER212 |
A | THR215 |
A | ASP321 |
A | ILE322 |
A | MET324 |
A | ASN325 |
A | EDO514 |
A | HOH605 |
site_id | AC6 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO A 506 |
Chain | Residue |
A | ASN283 |
A | ASP299 |
A | SER301 |
A | VAL302 |
A | ASP346 |
A | SER348 |
A | EDO522 |
site_id | AC7 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE EDO A 507 |
Chain | Residue |
A | GLY177 |
A | LEU178 |
A | ILE180 |
A | ASP241 |
A | LYS398 |
A | LEU402 |
A | TRP406 |
A | HOH611 |
site_id | AC8 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO A 508 |
Chain | Residue |
A | SER251 |
A | PRO253 |
A | ASP256 |
A | HOH669 |
site_id | AC9 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO A 509 |
Chain | Residue |
A | LEU249 |
A | THR252 |
A | TRP458 |
A | ASP465 |
site_id | BC1 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE EDO A 510 |
Chain | Residue |
A | ASP340 |
A | LYS349 |
A | ARG385 |
site_id | BC2 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE EDO A 511 |
Chain | Residue |
A | TYR297 |
A | HIS306 |
A | ALA309 |
site_id | BC3 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO A 512 |
Chain | Residue |
A | HIS234 |
A | GLY280 |
A | GLU413 |
A | PHE414 |
A | GLN417 |
A | EDO518 |
A | HOH625 |
site_id | BC4 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE EDO A 513 |
Chain | Residue |
A | SER212 |
A | HOH647 |
A | HOH671 |
site_id | BC5 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE EDO A 514 |
Chain | Residue |
A | SER212 |
A | ASP214 |
A | THR215 |
A | HIS319 |
A | EDO505 |
site_id | BC6 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE EDO A 515 |
Chain | Residue |
A | ARG331 |
A | ARG335 |
A | EDO516 |
site_id | BC7 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE EDO A 516 |
Chain | Residue |
A | ASP321 |
A | ARG331 |
A | ARG335 |
A | EDO515 |
A | HOH653 |
site_id | BC8 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO A 517 |
Chain | Residue |
A | ASN174 |
A | GLU202 |
A | HIS247 |
A | SER251 |
site_id | BC9 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE EDO A 518 |
Chain | Residue |
A | HOH693 |
A | HOH710 |
A | SER282 |
A | PRO430 |
A | CYS432 |
A | EDO512 |
site_id | CC1 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE EDO A 519 |
Chain | Residue |
A | LEU250 |
A | LEU255 |
A | ALA257 |
A | VAL258 |
A | PHE259 |
site_id | CC2 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE EDO A 520 |
Chain | Residue |
A | ARG203 |
A | ASP204 |
A | LEU205 |
A | THR208 |
A | ASP261 |
A | ILE264 |
A | HOH609 |
site_id | CC3 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE EDO A 521 |
Chain | Residue |
A | THR208 |
A | ASP261 |
A | GLN330 |
A | EDO504 |
A | HOH746 |
site_id | CC4 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE EDO A 522 |
Chain | Residue |
A | GLU300 |
A | ASP346 |
A | LYS349 |
A | EDO506 |
Functional Information from PROSITE/UniProt
site_id | PS00126 |
Number of Residues | 12 |
Details | PDEASE_I_1 3'5'-cyclic nucleotide phosphodiesterase domain signature. HDVdHpGvsNqF |
Chain | Residue | Details |
A | HIS274-PHE285 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 1 |
Details | ACT_SITE: Proton donor => ECO:0000305|PubMed:15003452, ECO:0007744|PDB:1ROR |
Chain | Residue | Details |
A | HIS234 |
site_id | SWS_FT_FI2 |
Number of Residues | 2 |
Details | BINDING: BINDING => ECO:0000269|PubMed:15003452, ECO:0000269|PubMed:15260978, ECO:0007744|PDB:1ROR, ECO:0007744|PDB:1TB5 |
Chain | Residue | Details |
A | HIS234 | |
A | GLN443 |
site_id | SWS_FT_FI3 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:15003452, ECO:0000269|PubMed:15260978, ECO:0000269|PubMed:15576036, ECO:0000269|PubMed:15685167, ECO:0000269|PubMed:17727341, ECO:0000269|PubMed:18539455, ECO:0007744|PDB:1RO6, ECO:0007744|PDB:1RO9, ECO:0007744|PDB:1ROR, ECO:0007744|PDB:1TB5, ECO:0007744|PDB:1XLX, ECO:0007744|PDB:1XLZ, ECO:0007744|PDB:1XM4, ECO:0007744|PDB:1XM6, ECO:0007744|PDB:1XMU, ECO:0007744|PDB:1XMY, ECO:0007744|PDB:1XN0, ECO:0007744|PDB:1XOS, ECO:0007744|PDB:1XOT, ECO:0007744|PDB:1Y2H, ECO:0007744|PDB:1Y2J, ECO:0007744|PDB:2QYL, ECO:0007744|PDB:3D3P |
Chain | Residue | Details |
A | HIS238 |
site_id | SWS_FT_FI4 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:10846163, ECO:0000269|PubMed:15003452, ECO:0000269|PubMed:15576036, ECO:0000269|PubMed:15685167, ECO:0000269|PubMed:17727341, ECO:0000269|PubMed:18539455, ECO:0007744|PDB:1F0J, ECO:0007744|PDB:1RO6, ECO:0007744|PDB:1RO9, ECO:0007744|PDB:1ROR, ECO:0007744|PDB:1XLX, ECO:0007744|PDB:1XLZ, ECO:0007744|PDB:1XM4, ECO:0007744|PDB:1XM6, ECO:0007744|PDB:1XMU, ECO:0007744|PDB:1XMY, ECO:0007744|PDB:1XN0, ECO:0007744|PDB:1XOS, ECO:0007744|PDB:1XOT, ECO:0007744|PDB:1Y2H, ECO:0007744|PDB:1Y2J, ECO:0007744|PDB:2QYL, ECO:0007744|PDB:3D3P |
Chain | Residue | Details |
A | HIS274 |
site_id | SWS_FT_FI5 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:15003452, ECO:0007744|PDB:1ROR |
Chain | Residue | Details |
A | ASP275 |
site_id | SWS_FT_FI6 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000269|PubMed:10846163, ECO:0000269|PubMed:15003452, ECO:0000269|PubMed:15260978, ECO:0000269|PubMed:15576036, ECO:0000269|PubMed:15685167, ECO:0000269|PubMed:18539455, ECO:0007744|PDB:1F0J, ECO:0007744|PDB:1RO6, ECO:0007744|PDB:1RO9, ECO:0007744|PDB:1ROR, ECO:0007744|PDB:1TB5, ECO:0007744|PDB:1XLX, ECO:0007744|PDB:1XLZ, ECO:0007744|PDB:1XM4, ECO:0007744|PDB:1XM6, ECO:0007744|PDB:1XMU, ECO:0007744|PDB:1XMY, ECO:0007744|PDB:1XN0, ECO:0007744|PDB:1XOS, ECO:0007744|PDB:1XOT, ECO:0007744|PDB:1Y2H, ECO:0007744|PDB:1Y2J, ECO:0007744|PDB:3D3P |
Chain | Residue | Details |
A | ASP392 |
site_id | SWS_FT_FI7 |
Number of Residues | 1 |
Details | BINDING: BINDING => ECO:0000305|PubMed:15003452, ECO:0000305|PubMed:15260978, ECO:0007744|PDB:1ROR, ECO:0007744|PDB:1TB5 |
Chain | Residue | Details |
A | PHE446 |
site_id | SWS_FT_FI8 |
Number of Residues | 1 |
Details | MOD_RES: Phosphoserine => ECO:0000250|UniProtKB:P14646 |
Chain | Residue | Details |
A | SER487 |