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BioLiP
Download all results in tab-seperated text for 713946 receptor-ligand interactions, whose format is explained at readme.txt.
  • Hover over PDB to view the title of the structure. Click PDB to view the structure at the RCSB PDB database. Resolution -1.00 means the resolution is unavailable, e.g., for NMR structures.
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  • Hover over Ligand to view the full ligand name. Click Ligand to view the 2D diagram and other detail information of the ligand.
  • Hover over EC number to view the full name of enzymatic activity.
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    # PDB
    (Resolution Å)
    Site # Ligand EC number GO terms UniProt PubMed Binding
    affinity
    15001 1hdd:C (2.8) BS02 dna ? GO:0000981 ... P02836 1977522
    15002 1hdd:D (2.8) BS01 dna ? GO:0000981 ... P02836 1977522
    15003 1hdd:D (2.8) BS02 dna ? GO:0000981 ... P02836 1977522
    15004 1hdf:A (2.35) BS01 CA ? GO:0005737 ... P09353 11250196
    15005 1hdf:A (2.35) BS02 CA ? GO:0005737 ... P09353 11250196
    15006 1hdf:B (2.35) BS01 CA ? GO:0005737 ... P09353 11250196
    15007 1hdf:B (2.35) BS02 CA ? GO:0005737 ... P09353 11250196
    15008 1hdg:O (2.5) BS01 NAD 1.2.1.12 GO:0000166 ... P17721 7877172
    15009 1hdg:Q (2.5) BS01 NAD 1.2.1.12 GO:0000166 ... P17721 7877172
    15010 1hdi:A (1.8) BS01 AMP 2.7.2.3 GO:0004618 ... Q7SIB7 11178909
    15011 1hdk:A (1.8) BS01 PMB 3.1.1.5 GO:0002667 ... Q05315 11834744
    15012 1hdk:A (1.8) BS02 PMB 3.1.1.5 GO:0002667 ... Q05315 11834744
    15013 1hdo:A (1.15) BS01 NAP 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15014 1hdq:A (2.3) BS01 INF 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=1.5uM
    PDBbind: -logKd/Ki=5.82, Ki=1.5uM
    15015 1hdq:A (2.3) BS02 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15016 1hdr:A (2.5) BS01 NAD 1.5.1.34 GO:0004155 ... P09417 8262916 MOAD: Kd=0.034uM
    15017 1hds:A (1.98) BS01 HEM ? GO:0004601 ... P01972 N/A
    15018 1hds:B (1.98) BS01 HEM ? GO:0004601 ... P02074 N/A
    15019 1hds:C (1.98) BS01 HEM ? GO:0004601 ... P01972 N/A
    15020 1hds:D (1.98) BS01 HEM ? GO:0004601 ... P02074 N/A
    15021 1hdt:H (2.6) BS01 peptide 3.4.21.5 GO:0004252 ... P00734 7853394
    15022 1hdt:H (2.6) BS02 0E7 3.4.21.5 GO:0004252 ... P00734 7853394 PDBbind: -logKd/Ki=7.76, Ki=17.2nM
    15023 1hdu:A (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15024 1hdu:A (1.75) BS02 ING 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=19uM
    15025 1hdu:B (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15026 1hdu:B (1.75) BS02 ING 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=19uM
    15027 1hdu:D (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15028 1hdu:D (1.75) BS02 ING 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=19uM
    15029 1hdu:E (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15030 1hdu:E (1.75) BS02 ING 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=19uM
    15031 1hdx:A (2.5) BS01 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15032 1hdx:A (2.5) BS02 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15033 1hdx:A (2.5) BS03 NAD 1.1.1.105 GO:0001523 ... P00325 8201622
    15034 1hdx:B (2.5) BS01 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15035 1hdx:B (2.5) BS02 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15036 1hdx:B (2.5) BS03 NAD 1.1.1.105 GO:0001523 ... P00325 8201622
    15037 1hdx:B (2.5) BS04 CXL 1.1.1.105 GO:0001523 ... P00325 8201622
    15038 1hdy:A (2.5) BS01 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15039 1hdy:A (2.5) BS02 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15040 1hdy:A (2.5) BS03 NAD 1.1.1.105 GO:0001523 ... P00325 8201622
    15041 1hdy:A (2.5) BS04 PYZ 1.1.1.105 GO:0001523 ... P00325 8201622
    15042 1hdy:B (2.5) BS01 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15043 1hdy:B (2.5) BS02 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15044 1hdy:B (2.5) BS03 NAD 1.1.1.105 GO:0001523 ... P00325 8201622
    15045 1hdy:B (2.5) BS04 PYZ 1.1.1.105 GO:0001523 ... P00325 8201622
    15046 1hdz:A (2.5) BS01 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15047 1hdz:A (2.5) BS02 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15048 1hdz:A (2.5) BS03 NAD 1.1.1.105 GO:0001523 ... P00325 8201622
    15049 1hdz:B (2.5) BS01 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15050 1hdz:B (2.5) BS02 ZN 1.1.1.105 GO:0001523 ... P00325 8201622
    15051 1hdz:B (2.5) BS03 NAD 1.1.1.105 GO:0001523 ... P00325 8201622
    15052 1he1:C (2.0) BS01 GDP 3.6.5.2 GO:0001764 ... P63000 11135665
    15053 1he1:C (2.0) BS02 AF3 3.6.5.2 GO:0001764 ... P63000 11135665
    15054 1he1:C (2.0) BS03 MG 3.6.5.2 GO:0001764 ... P63000 11135665
    15055 1he1:D (2.0) BS01 GDP 3.6.5.2 GO:0001764 ... P63000 11135665
    15056 1he1:D (2.0) BS02 AF3 3.6.5.2 GO:0001764 ... P63000 11135665
    15057 1he1:D (2.0) BS03 MG 3.6.5.2 GO:0001764 ... P63000 11135665
    15058 1he2:A (1.2) BS01 NAP 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15059 1he2:A (1.2) BS02 BLA 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15060 1he3:A (1.4) BS01 NAP 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15061 1he3:A (1.4) BS02 MBV 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15062 1he4:A (1.4) BS01 NAP 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15063 1he4:A (1.4) BS02 FMN 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15064 1he5:A (1.5) BS01 NAP 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15065 1he5:A (1.5) BS02 LUM 1.3.1.-
    1.5.1.30
    2.6.99.-
    GO:0004074 ... P30043 11224564
    15066 1he8:B (3.0) BS01 MG 3.6.5.2 GO:0003924 ... P01112 11136978
    15067 1he8:B (3.0) BS02 GNP 3.6.5.2 GO:0003924 ... P01112 11136978
    15068 1hea:A (2.0) BS01 ZN 4.2.1.1
    4.2.1.69
    GO:0002009 ... P00918 8485129
    15069 1heb:A (2.0) BS01 ZN 4.2.1.1
    4.2.1.69
    GO:0002009 ... P00918 8485129
    15070 1hec:A (2.0) BS01 ZN 4.2.1.1
    4.2.1.69
    GO:0002009 ... P00918 8485129
    15071 1hed:A (2.0) BS01 ZN 4.2.1.1
    4.2.1.69
    GO:0002009 ... P00918 8485129
    15072 1hee:A (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15073 1hee:A (1.75) BS02 LHY 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=4.6uM
    PDBbind: -logKd/Ki=5.34, Ki=4.6uM
    15074 1hee:B (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15075 1hee:B (1.75) BS02 LHY 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=4.6uM
    15076 1hee:D (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15077 1hee:D (1.75) BS02 LHY 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=4.6uM
    15078 1hee:E (1.75) BS01 ZN 3.4.17.1 GO:0004181 ... P00730 11937361
    15079 1hee:E (1.75) BS02 LHY 3.4.17.1 GO:0004181 ... P00730 11937361 MOAD: Ki=4.6uM
    15080 1hef:E (2.2) BS01 peptide 2.7.7.-
    2.7.7.49
    2.7.7.7
    3.1.-.-
    3.1.13.2
    3.1.26.13
    3.4.23.16
    GO:0004190 ... P03366 1429626
    15081 1heg:E (2.2) BS01 PSI 2.7.7.-
    2.7.7.49
    2.7.7.7
    3.1.-.-
    3.1.13.2
    3.1.26.13
    3.4.23.16
    GO:0004190 ... P03366 1429626 MOAD: Ki=18nM
    PDBbind: -logKd/Ki=7.74, Ki=18nM
    15082 1hes:A (3.0) BS01 peptide ? GO:0006886 ... P84092 11247301
    15083 1het:A (1.15) BS01 ZN 1.1.1.1 GO:0004022 ... P00327 11134046
    15084 1het:A (1.15) BS02 ZN 1.1.1.1 GO:0004022 ... P00327 11134046
    15085 1het:A (1.15) BS03 NAD 1.1.1.1 GO:0004022 ... P00327 11134046
    15086 1het:B (1.15) BS01 ZN 1.1.1.1 GO:0004022 ... P00327 11134046
    15087 1het:B (1.15) BS02 ZN 1.1.1.1 GO:0004022 ... P00327 11134046
    15088 1het:B (1.15) BS03 NAD 1.1.1.1 GO:0004022 ... P00327 11134046
    15089 1heu:A (1.15) BS01 NAD 1.1.1.1 GO:0004022 ... P00327 11134046
    15090 1heu:B (1.15) BS01 NAD 1.1.1.1 GO:0004022 ... P00327 11134046
    15091 1hex:A (2.5) BS01 NAD 1.1.1.85 GO:0000287 ... Q5SIY4 7881901 MOAD: Ki=614.6uM
    15092 1hf0:A (2.7) BS01 dna ? GO:0000981 ... P14859 11583619
    15093 1hf0:A (2.7) BS02 dna ? GO:0000981 ... P14859 11583619
    15094 1hf0:B (2.7) BS01 dna ? GO:0000981 ... P14859 11583619
    15095 1hf0:B (2.7) BS02 dna ? GO:0000981 ... P14859 11583619
    15096 1hf3:A (1.95) BS01 NAD 1.1.1.1 GO:0004022 ... P00327 11134046
    15097 1hf3:B (1.95) BS01 NAD 1.1.1.1 GO:0004022 ... P00327 11134046
    15098 1hf4:A (1.45) BS01 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15099 1hf4:A (1.45) BS02 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15100 1hf4:A (1.45) BS03 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15101 1hf4:B (1.45) BS01 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15102 1hf4:B (1.45) BS02 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15103 1hf4:B (1.45) BS03 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15104 1hf4:B (1.45) BS04 NO3 3.2.1.17 GO:0003796 ... P00698 11418760
    15105 1hf6:A (1.15) BS01 GLC 3.2.1.4 GO:0000272 ... O85465 12595701
    15106 1hf6:A (1.15) BS02 BGC 3.2.1.4 GO:0000272 ... O85465 12595701
    15107 1hf6:A (1.15) BS03 BGC 3.2.1.4 GO:0000272 ... O85465 12595701
    15108 1hfa:A (2.0) BS01 PIO ? GO:0005543 ... O55012 11161218
    15109 1hfb:A (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15110 1hfb:B (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15111 1hfb:C (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15112 1hfb:D (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15113 1hfb:E (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15114 1hfb:F (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15115 1hfb:G (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15116 1hfb:H (1.9) BS01 PEP 2.5.1.54 GO:0003849 ... P32449 12540830
    15117 1hfc:A (1.5) BS01 ZN 3.4.24.7 GO:0004222 ... P03956 8090713
    15118 1hfc:A (1.5) BS02 ZN 3.4.24.7 GO:0004222 ... P03956 8090713
    15119 1hfc:A (1.5) BS03 CA 3.4.24.7 GO:0004222 ... P03956 8090713
    15120 1hfc:A (1.5) BS04 PLH 3.4.24.7 GO:0004222 ... P03956 8090713
    15121 1hfp:A (2.1) BS01 NDP 1.5.1.3 GO:0000900 ... P00374 9627670
    15122 1hfp:A (2.1) BS02 MOT 1.5.1.3 GO:0000900 ... P00374 9627670 MOAD: Ki=1036nM
    15123 1hfq:A (2.1) BS01 NDP 1.5.1.3 GO:0000900 ... P00374 9627670
    15124 1hfq:A (2.1) BS02 MOT 1.5.1.3 GO:0000900 ... P00374 9627670 MOAD: Ki=2.7nM
    15125 1hfr:A (2.1) BS01 NDP 1.5.1.3 GO:0000900 ... P00374 9627670
    15126 1hfr:A (2.1) BS02 MOT 1.5.1.3 GO:0000900 ... P00374 9627670 MOAD: Ki=790nM
    15127 1hfs:A (1.7) BS01 ZN 3.4.24.17 GO:0004222 ... P08254 9083493
    15128 1hfs:A (1.7) BS02 ZN 3.4.24.17 GO:0004222 ... P08254 9083493
    15129 1hfs:A (1.7) BS03 CA 3.4.24.17 GO:0004222 ... P08254 9083493
    15130 1hfs:A (1.7) BS04 CA 3.4.24.17 GO:0004222 ... P08254 9083493
    15131 1hfs:A (1.7) BS05 CA 3.4.24.17 GO:0004222 ... P08254 9083493
    15132 1hfs:A (1.7) BS06 L04 3.4.24.17 GO:0004222 ... P08254 9083493 MOAD: Ki=2nM
    PDBbind: -logKd/Ki=8.70, Ki=2nM
    BindingDB: Ki=2nM
    15133 1hfw:A (1.8) BS01 GLU 3.5.1.1 GO:0004067 ... P06608 11341830
    15134 1hfw:B (1.8) BS01 GLU 3.5.1.1 GO:0004067 ... P06608 11341830
    15135 1hfw:C (1.8) BS01 GLU 3.5.1.1 GO:0004067 ... P06608 11341830
    15136 1hfw:D (1.8) BS01 GLU 3.5.1.1 GO:0004067 ... P06608 11341830
    15137 1hfx:A (1.9) BS01 CA 2.4.1.22 GO:0003796 ... P00713 8805552
    15138 1hfy:A (2.3) BS01 CA 2.4.1.22 GO:0003796 ... P00712 8805552
    15139 1hfy:B (2.3) BS01 CA 2.4.1.22 GO:0003796 ... P00712 8805552
    15140 1hfz:A (2.3) BS01 CA 2.4.1.22 GO:0003796 ... P00711 8805552
    15141 1hfz:B (2.3) BS01 CA 2.4.1.22 GO:0003796 ... P00711 8805552
    15142 1hfz:C (2.3) BS01 CA 2.4.1.22 GO:0003796 ... P00711 8805552
    15143 1hfz:D (2.3) BS01 CA 2.4.1.22 GO:0003796 ... P00711 8805552
    15144 1hg0:A (1.9) BS01 SIN 3.5.1.1 GO:0004067 ... P06608 11341830
    15145 1hg0:B (1.9) BS01 SIN 3.5.1.1 GO:0004067 ... P06608 11341830
    15146 1hg0:C (1.9) BS01 SIN 3.5.1.1 GO:0004067 ... P06608 11341830
    15147 1hg0:D (1.9) BS01 SIN 3.5.1.1 GO:0004067 ... P06608 11341830
    15148 1hg1:A (1.8) BS01 DAS 3.5.1.1 GO:0004067 ... P06608 11341830
    15149 1hg1:B (1.8) BS01 DAS 3.5.1.1 GO:0004067 ... P06608 11341830
    15150 1hg1:C (1.8) BS01 DAS 3.5.1.1 GO:0004067 ... P06608 11341830
    15151 1hg1:D (1.8) BS01 DAS 3.5.1.1 GO:0004067 ... P06608 11341830
    15152 1hg2:A (2.0) BS01 IP2 ? GO:0005543 ... O55012 11161218
    15153 1hg3:A (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15154 1hg3:B (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15155 1hg3:C (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15156 1hg3:D (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15157 1hg3:E (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15158 1hg3:F (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15159 1hg3:G (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15160 1hg3:H (2.7) BS01 3PP 5.3.1.1 GO:0004807 ... P62003 11243785
    15161 1hg5:A (2.0) BS01 IHP ? GO:0005543 ... O55012 11161218
    15162 1hga:A (2.1) BS01 HEM ? GO:0004601 ... P69905 1453464
    15163 1hga:B (2.1) BS01 HEM ? GO:0004601 ... P68871 1453464
    15164 1hga:C (2.1) BS01 HEM ? GO:0004601 ... P69905 1453464
    15165 1hga:D (2.1) BS01 HEM ? GO:0004601 ... P68871 1453464
    15166 1hgb:A (2.1) BS01 HEM ? GO:0004601 ... P69905 1453464
    15167 1hgb:B (2.1) BS01 HEM ? GO:0004601 ... P68871 1453464
    15168 1hgb:C (2.1) BS01 HEM ? GO:0004601 ... P69905 1453464
    15169 1hgb:D (2.1) BS01 HEM ? GO:0004601 ... P68871 1453464
    15170 1hgc:A (2.1) BS01 HEM ? GO:0004601 ... P69905 1453464
    15171 1hgc:A (2.1) BS02 OXY ? GO:0004601 ... P69905 1453464
    15172 1hgc:B (2.1) BS01 HEM ? GO:0004601 ... P68871 1453464
    15173 1hgc:C (2.1) BS01 HEM ? GO:0004601 ... P69905 1453464
    15174 1hgc:C (2.1) BS02 OXY ? GO:0004601 ... P69905 1453464
    15175 1hgc:D (2.1) BS01 HEM ? GO:0004601 ... P68871 1453464
    15176 1hge:A (2.6) BS01 MNA ? GO:0019031 ... P03438 1327122 PDBbind: -logKd/Ki=2.27, Kd=5.4mM
    15177 1hge:C (2.6) BS01 MNA ? GO:0019031 ... P03438 1327122
    15178 1hge:E (2.6) BS01 MNA ? GO:0019031 ... P03438 1327122
    15179 1hgg:A (2.9) BS01 GAL ? GO:0019031 ... P03437 1327122
    15180 1hgg:A (2.9) BS02 SIA ? GO:0019031 ... P03437 1327122
    15181 1hgg:A (2.9) BS03 BGC ? GO:0019031 ... P03437 1327122
    15182 1hgg:A (2.9) BS04 SIA ? GO:0019031 ... P03437 1327122
    15183 1hgg:B (2.9) BS01 SIA ? GO:0019031 ... P03437 1327122
    15184 1hgg:C (2.9) BS01 GAL ? GO:0019031 ... P03437 1327122
    15185 1hgg:C (2.9) BS02 SIA ? GO:0019031 ... P03437 1327122
    15186 1hgg:C (2.9) BS03 BGC ? GO:0019031 ... P03437 1327122
    15187 1hgg:C (2.9) BS04 SIA ? GO:0019031 ... P03437 1327122
    15188 1hgg:D (2.9) BS01 SIA ? GO:0019031 ... P03437 1327122
    15189 1hgg:E (2.9) BS01 GAL ? GO:0019031 ... P03437 1327122
    15190 1hgg:E (2.9) BS02 SIA ? GO:0019031 ... P03437 1327122
    15191 1hgg:E (2.9) BS03 BGC ? GO:0019031 ... P03437 1327122
    15192 1hgg:E (2.9) BS04 SIA ? GO:0019031 ... P03437 1327122
    15193 1hgg:F (2.9) BS01 SIA ? GO:0019031 ... P03437 1327122
    15194 1hgh:A (2.7) BS01 MNA ? GO:0019031 ... P03438 1327122
    15195 1hgh:A (2.7) BS02 MNA ? GO:0019031 ... P03438 1327122
    15196 1hgh:B (2.7) BS01 MNA ? GO:0019031 ... P03438 1327122
    15197 1hgh:C (2.7) BS01 MNA ? GO:0019031 ... P03438 1327122
    15198 1hgh:C (2.7) BS02 MNA ? GO:0019031 ... P03438 1327122
    15199 1hgh:D (2.7) BS01 MNA ? GO:0019031 ... P03438 1327122
    15200 1hgh:E (2.7) BS01 MNA ? GO:0019031 ... P03438 1327122

    Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).
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