SEQ2FUN

BioLiP
Download all results in tab-seperated text for 1072681 receptor-ligand interactions, whose format is explained at readme.txt.
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    # PDB
    (Resolution Å)
    Site # Ligand EC number GO terms UniProt PubMed Binding
    affinity
    169201 3nip:C (2.5) BS01 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169202 3nip:C (2.5) BS02 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169203 3nip:D (2.5) BS01 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169204 3nip:D (2.5) BS02 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169205 3nip:E (2.5) BS01 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169206 3nip:E (2.5) BS02 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169207 3nip:F (2.5) BS01 16D 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169208 3niq:A (2.07) BS01 MN 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169209 3niq:A (2.07) BS02 MN 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169210 3niq:B (2.07) BS01 MN 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169211 3niq:B (2.07) BS02 MN 3.5.3.17 GO:0008783 ... Q9I6K2 21600989
    169212 3nis:A (1.68) BS01 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169213 3nis:A (1.68) BS02 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169214 3nis:A (1.68) BS03 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169215 3nis:B (1.68) BS01 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169216 3nis:B (1.68) BS02 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169217 3nis:B (1.68) BS03 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169218 3nis:D (1.68) BS01 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169219 3nis:D (1.68) BS02 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169220 3nis:D (1.68) BS03 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169221 3nis:F (1.68) BS01 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169222 3nis:F (1.68) BS02 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169223 3nis:F (1.68) BS03 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169224 3nit:A (2.6) BS01 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169225 3nit:A (2.6) BS02 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169226 3nit:A (2.6) BS03 ZN 2.3.2.27 GO:0008270 ... P19812 20835240
    169227 3niu:A (2.94) BS01 CA 1.11.1.7 GO:0004601 ... A0A452E9Y6 N/A
    169228 3niu:A (2.94) BS02 HEM 1.11.1.7 GO:0004601 ... A0A452E9Y6 N/A
    169229 3niu:B (2.94) BS01 CA 1.11.1.7 GO:0004601 ... A0A452E9Y6 N/A
    169230 3niu:B (2.94) BS02 HEM 1.11.1.7 GO:0004601 ... A0A452E9Y6 N/A
    169231 3niw:A (1.9) BS01 MG ? GO:0000287 ... Q8A2F3 N/A
    169232 3nix:A (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169233 3nix:B (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169234 3nix:C (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169235 3nix:D (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169236 3nix:E (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169237 3nix:F (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169238 3nix:G (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169239 3nix:H (2.6) BS01 FAD N/A GO:0071949 ... N/A N/A
    169240 3niz:A (2.4) BS01 MG 2.7.11.22
    2.7.11.23
    GO:0000166 ... Q5CRJ8 N/A
    169241 3niz:A (2.4) BS02 ADP 2.7.11.22
    2.7.11.23
    GO:0000166 ... Q5CRJ8 N/A
    169242 3nj0:A (1.89) BS01 PYV ? GO:0004864 ... O80992 20729860
    169243 3nj0:B (1.89) BS01 PYV ? GO:0004864 ... O80992 20729860
    169244 3nj0:C (1.89) BS01 PYV ? GO:0004864 ... O80992 20729860
    169245 3nj1:A (1.948) BS01 PYV ? GO:0004864 ... O80992 20729860
    169246 3nj1:A (1.948) BS02 P2M ? GO:0004864 ... O80992 20729860
    169247 3nj3:A (1.88) BS01 XYP 3.2.1.8 GO:0004553 ... A5IL00 21070746
    169248 3nj3:A (1.88) BS02 XYP 3.2.1.8 GO:0004553 ... A5IL00 21070746
    169249 3nj3:B (1.88) BS01 XYP 3.2.1.8 GO:0004553 ... A5IL00 21070746
    169250 3nj3:B (1.88) BS02 XYP 3.2.1.8 GO:0004553 ... A5IL00 21070746
    169251 3nj4:A (2.5) BS01 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169252 3nj4:A (2.5) BS02 AFX 3.13.2.1 GO:0004013 ... P23526 21226494 MOAD: ic50=0.48uM
    169253 3nj4:A (2.5) BS03 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169254 3nj4:B (2.5) BS01 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169255 3nj4:B (2.5) BS02 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169256 3nj4:B (2.5) BS03 AFX 3.13.2.1 GO:0004013 ... P23526 21226494 MOAD: ic50=0.48uM
    169257 3nj4:C (2.5) BS01 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169258 3nj4:C (2.5) BS02 AFX 3.13.2.1 GO:0004013 ... P23526 21226494 MOAD: ic50=0.48uM
    169259 3nj4:C (2.5) BS03 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169260 3nj4:D (2.5) BS01 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169261 3nj4:D (2.5) BS02 NAD 3.13.2.1 GO:0004013 ... P23526 21226494
    169262 3nj4:D (2.5) BS03 AFX 3.13.2.1 GO:0004013 ... P23526 21226494 MOAD: ic50=0.48uM
    169263 3nj8:A (2.7) BS01 NAD 1.3.1.9 GO:0004318 ... Q6UCJ9 20698542
    169264 3nj8:A (2.7) BS02 NJ8 1.3.1.9 GO:0004318 ... Q6UCJ9 20698542
    169265 3nj8:B (2.7) BS01 NAD 1.3.1.9 GO:0004318 ... Q6UCJ9 20698542
    169266 3nj8:B (2.7) BS02 NJ8 1.3.1.9 GO:0004318 ... Q6UCJ9 20698542
    169267 3nj9:A (2.0) BS01 ZN 4.2.1.1
    4.2.1.69
    GO:0004064 ... P00918 N/A
    169268 3nj9:A (2.0) BS02 TE2 4.2.1.1
    4.2.1.69
    GO:0004064 ... P00918 N/A
    169269 3njf:A (2.47) BS01 peptide ? N/A Q8EGA7 22493430
    169270 3njf:C (2.47) BS01 peptide ? N/A Q8EGA7 22493430
    169271 3njg:A (1.92) BS01 peptide ? N/A Q8EGA7 22493430
    169272 3njh:A (1.94) BS01 CA ? N/A Q8EGA7 22493430
    169273 3njh:B (1.94) BS01 CA ? N/A Q8EGA7 22493430
    169274 3njh:C (1.94) BS01 CA ? N/A Q8EGA7 22493430
    169275 3njh:D (1.94) BS01 CA ? N/A Q8EGA7 22493430
    169276 3nji:A (1.8) BS01 peptide ? N/A Q8EGA7 22493430
    169277 3njj:A (1.56) BS01 peptide ? N/A Q8EGA7 22493430
    169278 3njl:A (1.75) BS01 MG ? N/A Q8EGA7 22493430
    169279 3njn:A (1.25) BS01 peptide ? N/A Q8EGA7 22493430
    169280 3njn:A (1.25) BS02 CA ? N/A Q8EGA7 22493430
    169281 3njn:C (1.25) BS01 peptide ? N/A Q8EGA7 22493430
    169282 3njo:A (2.473) BS01 PYV ? GO:0004864 ... O49686 20729860
    169283 3njo:B (2.473) BS01 P2M ? GO:0004864 ... O49686 20729860
    169284 3njo:C (2.473) BS01 PYV ? GO:0004864 ... O49686 20729860
    169285 3njq:A (2.0) BS01 NJQ 3.4.21.97 GO:0004252 ... P88911 21723875 MOAD: Kd=1.7uM
    169286 3njq:B (2.0) BS01 NJQ 3.4.21.97 GO:0004252 ... P88911 21723875 MOAD: Kd=1.7uM
    169287 3njq:B (2.0) BS02 NJQ 3.4.21.97 GO:0004252 ... P88911 21723875 MOAD: Kd=1.7uM
    169288 3njr:A (2.7) BS01 SAH 2.1.1.132 GO:0008276 ... D5AV04 23042036
    169289 3njr:B (2.7) BS01 SAH 2.1.1.132 GO:0008276 ... D5AV04 23042036
    169290 3njs:A (2.1) BS01 BGC 3.2.2.22 GO:0017148 ... D9J2T9 N/A
    169291 3njs:A (2.1) BS02 GAL 3.2.2.22 GO:0017148 ... D9J2T9 N/A
    169292 3nju:A (1.4) BS01 ANN 3.1.1.4 GO:0004623 ... P60045 N/A
    169293 3nju:A (1.4) BS02 CA 3.1.1.4 GO:0004623 ... P60045 N/A
    169294 3njv:A (2.4) BS01 GTR 4.2.2.23 GO:0005576 ... Q00019 20851126
    169295 3njv:A (2.4) BS02 GTR 4.2.2.23 GO:0005576 ... Q00019 20851126
    169296 3njv:A (2.4) BS03 GTR 4.2.2.23 GO:0005576 ... Q00019 20851126
    169297 3njv:A (2.4) BS04 RAM 4.2.2.23 GO:0005576 ... Q00019 20851126
    169298 3njv:A (2.4) BS05 CA 4.2.2.23 GO:0005576 ... Q00019 20851126
    169299 3njx:A (1.94) BS01 CA 4.2.2.23 GO:0005576 ... Q00019 20851126
    169300 3njy:A (2.6) BS01 ZN 1.14.11.66
    1.14.11.69
    N/A O75164 21124847
    169301 3njy:A (2.6) BS02 8XQ 1.14.11.66
    1.14.11.69
    N/A O75164 21124847 BindingDB: IC50=1700nM, EC50=87000nM
    169302 3njy:B (2.6) BS01 ZN 1.14.11.66
    1.14.11.69
    N/A O75164 21124847
    169303 3njy:B (2.6) BS02 8XQ 1.14.11.66
    1.14.11.69
    N/A O75164 21124847 BindingDB: IC50=1700nM, EC50=87000nM
    169304 3njz:A (2.1) BS01 FE2 1.13.11.4 GO:0016491 ... Q67FT0 22155290
    169305 3nk0:X (2.15) BS01 HNK 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169306 3nk0:X (2.15) BS02 FAD 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169307 3nk0:X (2.15) BS03 GP7 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169308 3nk0:X (2.15) BS04 HNM 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169309 3nk1:X (2.2) BS01 SRO 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169310 3nk1:X (2.2) BS02 FAD 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169311 3nk1:X (2.2) BS03 GP7 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169312 3nk2:X (2.65) BS01 LDP 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169313 3nk2:X (2.65) BS02 FAD 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169314 3nk2:X (2.65) BS03 GP7 1.5.3.5 GO:0005737 ... Q93NH4 20006620
    169315 3nk3:A (2.6) BS01 peptide ? N/A P79762 20970175
    169316 3nk3:B (2.6) BS01 peptide ? N/A P79762 20970175
    169317 3nk3:B (2.6) BS02 peptide ? N/A P79762 20970175
    169318 3nk4:A (2.0) BS01 peptide ? N/A P79762 20970175
    169319 3nk4:B (2.0) BS01 peptide ? N/A P79762 20970175
    169320 3nk4:B (2.0) BS02 peptide ? N/A P79762 20970175
    169321 3nk7:A (2.1) BS01 SAM 2.1.1.230 GO:0003723 ... P52391 20550164
    169322 3nk7:A (2.1) BS02 SAM 2.1.1.230 GO:0003723 ... P52391 20550164
    169323 3nk7:B (2.1) BS01 SAM 2.1.1.230 GO:0003723 ... P52391 20550164
    169324 3nk7:B (2.1) BS02 SAM 2.1.1.230 GO:0003723 ... P52391 20550164
    169325 3nk8:A (1.15) BS01 CA 3.4.21.4 GO:0004175 ... P00760 20886466
    169326 3nk8:A (1.15) BS02 JKZ 3.4.21.4 GO:0004175 ... P00760 20886466
    169327 3nk9:A (1.65) BS01 THP 3.1.31.1 GO:0003676 ... P00644 22496593
    169328 3nk9:A (1.65) BS02 CA 3.1.31.1 GO:0003676 ... P00644 22496593
    169329 3nka:A (2.5) BS01 GOL ? GO:0005515 ... P60844 20855585
    169330 3nke:C (1.4) BS01 SO3 3.1.-.- GO:0003676 ... Q46896 21219465
    169331 3nkk:A (1.12) BS01 CA 3.4.21.4 GO:0004175 ... P00760 20886466
    169332 3nkk:A (1.12) BS02 JLZ 3.4.21.4 GO:0004175 ... P00760 20886466 MOAD: Kd=20uM
    169333 3nkm:A (2.002) BS01 MAN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169334 3nkm:A (2.002) BS02 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169335 3nkm:A (2.002) BS03 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169336 3nkm:A (2.002) BS04 CA 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169337 3nkm:A (2.002) BS05 NKP 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169338 3nkn:A (1.8) BS01 MAN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169339 3nkn:A (1.8) BS02 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169340 3nkn:A (1.8) BS03 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169341 3nkn:A (1.8) BS04 CA 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169342 3nkn:A (1.8) BS05 NKN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169343 3nko:A (1.75) BS01 MAN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169344 3nko:A (1.75) BS02 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169345 3nko:A (1.75) BS03 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169346 3nko:A (1.75) BS04 CA 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169347 3nko:A (1.75) BS05 NKO 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169348 3nkp:A (1.751) BS01 MAN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169349 3nkp:A (1.751) BS02 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169350 3nkp:A (1.751) BS03 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169351 3nkp:A (1.751) BS04 CA 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169352 3nkp:A (1.751) BS05 NKP 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169353 3nkq:A (1.7) BS01 MAN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169354 3nkq:A (1.7) BS02 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169355 3nkq:A (1.7) BS03 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169356 3nkq:A (1.7) BS04 CA 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169357 3nkq:A (1.7) BS05 NKQ 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169358 3nkq:A (1.7) BS06 NKQ 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169359 3nkr:A (1.704) BS01 MAN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169360 3nkr:A (1.704) BS02 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169361 3nkr:A (1.704) BS03 ZN 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169362 3nkr:A (1.704) BS04 CA 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169363 3nkr:A (1.704) BS05 NKR 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169364 3nkr:A (1.704) BS06 NKR 3.1.4.39 GO:0001953 ... Q9R1E6 21240269
    169365 3nks:A (1.9) BS01 ACJ 1.3.3.4 GO:0004729 ... P50336 21048046 BindingDB: Ki=1710nM
    169366 3nks:A (1.9) BS02 FAD 1.3.3.4 GO:0004729 ... P50336 21048046
    169367 3nkt:A (2.35) BS01 FE2 1.13.11.4 GO:0016491 ... Q67FT0 22155290
    169368 3nkt:A (2.35) BS02 1HN 1.13.11.4 GO:0016491 ... Q67FT0 22155290
    169369 3nkv:A (1.7) BS01 GNP 3.6.5.2 GO:0003924 ... Q9H0U4 20651120
    169370 3nkv:A (1.7) BS02 MG 3.6.5.2 GO:0003924 ... Q9H0U4 20651120
    169371 3nkv:A (1.7) BS03 AMP 3.6.5.2 GO:0003924 ... Q9H0U4 20651120
    169372 3nkv:B (1.7) BS01 GNP 3.6.5.2 GO:0003924 ... Q9H0U4 20651120
    169373 3nkv:B (1.7) BS02 MG 3.6.5.2 GO:0003924 ... Q9H0U4 20651120
    169374 3nkv:B (1.7) BS03 AMP 3.6.5.2 GO:0003924 ... Q9H0U4 20651120
    169375 3nkx:A (2.4) BS01 peptide ? GO:0000122 ... P63104 20679480
    169376 3nkx:B (2.4) BS01 peptide ? GO:0000122 ... P63104 20679480
    169377 3nl0:A (2.6) BS01 rna 3.4.22.46
    3.6.1.15
    GO:0003723 ... Q9QCE4 20865120
    169378 3nl0:A (2.6) BS02 rna 3.4.22.46
    3.6.1.15
    GO:0003723 ... Q9QCE4 20865120
    169379 3nl0:A (2.6) BS03 MG 3.4.22.46
    3.6.1.15
    GO:0003723 ... Q9QCE4 20865120
    169380 3nl1:A (2.155) BS01 FE2 1.13.11.4 GO:0016491 ... Q67FT0 22155290
    169381 3nl1:A (2.155) BS02 GTQ 1.13.11.4 GO:0016491 ... Q67FT0 22155290
    169382 3nl3:A (3.007) BS01 TPS 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169383 3nl3:A (3.007) BS02 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169384 3nl3:A (3.007) BS03 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169385 3nl3:A (3.007) BS04 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169386 3nl3:B (3.007) BS01 TPS 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169387 3nl3:B (3.007) BS02 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169388 3nl3:C (3.007) BS01 TPS 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169389 3nl3:C (3.007) BS02 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169390 3nl3:D (3.007) BS01 TPS 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169391 3nl3:D (3.007) BS02 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169392 3nl3:D (3.007) BS03 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169393 3nl3:E (3.007) BS01 TPS 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169394 3nl3:E (3.007) BS02 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169395 3nl3:F (3.007) BS01 TPS 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169396 3nl3:F (3.007) BS02 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169397 3nl5:A (3.3) BS01 ACP 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169398 3nl5:B (3.3) BS01 MG 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169399 3nl5:B (3.3) BS02 ACP 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298
    169400 3nl5:B (3.3) BS03 TZE 2.5.1.3
    2.7.1.50
    GO:0000287 ... Q6FV03 20968298

    Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).