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BioLiP
Download all results in tab-seperated text for 832530 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.
  • Hover over GO terms to view all GO terms.
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    # PDB
    (Resolution Å)
    Site # Ligand EC number GO terms UniProt PubMed Binding
    affinity
    7801 1djw:A (2.45) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7802 1djw:A (2.45) BS03 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7803 1djw:A (2.45) BS04 CIP 3.1.4.11 GO:0004435 ... P10688 9048554
    7804 1djw:B (2.45) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7805 1djw:B (2.45) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7806 1djw:B (2.45) BS03 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7807 1djw:B (2.45) BS04 CIP 3.1.4.11 GO:0004435 ... P10688 9048554
    7808 1djx:A (2.3) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7809 1djx:A (2.3) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7810 1djx:A (2.3) BS03 I3P 3.1.4.11 GO:0004435 ... P10688 9048554 MOAD: Kd=1.7uM
    7811 1djx:B (2.3) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7812 1djx:B (2.3) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7813 1djx:B (2.3) BS03 I3P 3.1.4.11 GO:0004435 ... P10688 9048554 MOAD: Kd=1.7uM
    7814 1djy:A (2.8) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7815 1djy:A (2.8) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7816 1djy:A (2.8) BS03 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7817 1djy:A (2.8) BS04 I2P 3.1.4.11 GO:0004435 ... P10688 9048554
    7818 1djy:B (2.8) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7819 1djy:B (2.8) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7820 1djy:B (2.8) BS03 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7821 1djy:B (2.8) BS04 I2P 3.1.4.11 GO:0004435 ... P10688 9048554
    7822 1djz:A (2.95) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7823 1djz:A (2.95) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7824 1djz:A (2.95) BS03 IP2 3.1.4.11 GO:0004435 ... P10688 9048554
    7825 1djz:B (2.95) BS01 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7826 1djz:B (2.95) BS02 CA 3.1.4.11 GO:0004435 ... P10688 9048554
    7827 1djz:B (2.95) BS03 IP2 3.1.4.11 GO:0004435 ... P10688 9048554
    7828 1dk0:A (1.77) BS01 HEM ? GO:0005515 ... Q54450 10966573
    7829 1dk0:B (1.77) BS01 HEM ? GO:0005515 ... Q54450 10966573
    7830 1dk1:A (2.8) BS01 rna ? GO:0003735 ... P80378 10742169
    7831 1dk4:A (2.6) BS01 ZN 3.1.3.11
    3.1.3.25
    GO:0006020 ... Q57573 11062561
    7832 1dk4:A (2.6) BS02 ZN 3.1.3.11
    3.1.3.25
    GO:0006020 ... Q57573 11062561
    7833 1dk4:B (2.6) BS01 ZN 3.1.3.11
    3.1.3.25
    GO:0006020 ... Q57573 11062561
    7834 1dk4:B (2.6) BS02 ZN 3.1.3.11
    3.1.3.25
    GO:0006020 ... Q57573 11062561
    7835 1dka:A (2.6) BS01 K 4.1.1.64 GO:0008453 ... P16932 8342040
    7836 1dka:A (2.6) BS02 PLP 4.1.1.64 GO:0008453 ... P16932 8342040
    7837 1dkd:A (2.1) BS01 peptide 5.6.1.7 GO:0042026 ... P0A6F5 10619429
    7838 1dkd:B (2.1) BS01 peptide 5.6.1.7 GO:0042026 ... P0A6F5 10619429
    7839 1dkd:C (2.1) BS01 peptide 5.6.1.7 GO:0042026 ... P0A6F5 10619429
    7840 1dkd:D (2.1) BS01 peptide 5.6.1.7 GO:0042026 ... P0A6F5 10619429
    7841 1dke:A (2.1) BS01 HEM ? GO:0004601 ... P69905 10794410
    7842 1dke:B (2.1) BS01 HEM ? GO:0004601 ... P68871 10794410
    7843 1dke:C (2.1) BS01 HEM ? GO:0004601 ... P69905 10794410
    7844 1dke:D (2.1) BS01 HEM ? GO:0004601 ... P68871 10794410
    7845 1dkf:B (2.5) BS01 BMS ? GO:0003677 ... P10276 10882070
    7846 1dkh:A (3.2) BS01 HEM ? GO:0005515 ... Q54450 10966573
    7847 1dko:A (2.38) BS01 WO4 3.1.3.-
    3.6.1.-
    GO:0003924 ... P07102 10655611
    7848 1dkp:A (2.28) BS01 IHP 3.1.3.-
    3.6.1.-
    GO:0003924 ... P07102 10655611
    7849 1dkq:A (2.05) BS01 IHP 3.1.3.-
    3.6.1.-
    GO:0003924 ... P07102 10655611
    7850 1dks:A (3.2) BS01 PO4 ? GO:0000307 ... P61024 7791211
    7851 1dks:B (3.2) BS01 PO4 ? GO:0000307 ... P61024 7791211
    7852 1dkt:A (2.9) BS01 V7O ? GO:0000307 ... P61024 7791211
    7853 1dkt:B (2.9) BS01 V7O ? GO:0000307 ... P61024 7791211
    7854 1dku:A (2.2) BS01 AP2 2.7.6.1 GO:0000287 ... P14193 10742175
    7855 1dku:A (2.2) BS02 ABM 2.7.6.1 GO:0000287 ... P14193 10742175
    7856 1dku:A (2.2) BS03 AP2 2.7.6.1 GO:0000287 ... P14193 10742175
    7857 1dku:B (2.2) BS01 AP2 2.7.6.1 GO:0000287 ... P14193 10742175
    7858 1dku:B (2.2) BS02 AP2 2.7.6.1 GO:0000287 ... P14193 10742175
    7859 1dku:B (2.2) BS03 ABM 2.7.6.1 GO:0000287 ... P14193 10742175
    7860 1dkx:A (2.0) BS01 peptide ? GO:0005524 ... P0A6Y8 8658133
    7861 1dky:A (2.8) BS01 peptide ? GO:0005524 ... P0A6Y8 8658133
    7862 1dky:B (2.8) BS01 peptide ? GO:0005524 ... P0A6Y8 8658133
    7863 1dkz:A (2.0) BS01 peptide ? GO:0005524 ... P0A6Y8 8658133
    7864 1dl5:A (1.8) BS01 SAH 2.1.1.77 GO:0004719 ... Q56308 11080641
    7865 1dl5:B (1.8) BS01 SAH 2.1.1.77 GO:0004719 ... Q56308 11080641
    7866 1dl6:A (-1.00) BS01 ZN 2.3.1.48 GO:0006352 ... Q00403 11045620
    7867 1dl7:H (2.35) BS01 NCH ? GO:0002250 ... P01820 10859335 PDBbind: -logKd/Ki=6.49, Kd=0.32uM
    7868 1dl7:L (2.35) BS01 NCH ? GO:0002250 ... P01724 10859335 MOAD: Kd=0.32uM
    PDBbind: -logKd/Ki=6.49, Kd=0.32uM
    7869 1dlh:A (2.8) BS01 peptide ? GO:0006955 ... P01903 8145819
    7870 1dlh:B (2.8) BS01 peptide ? GO:0006955 ... P01911 8145819
    7871 1dlh:D (2.8) BS01 peptide ? GO:0006955 ... P01903 8145819
    7872 1dlh:E (2.8) BS01 peptide ? GO:0006955 ... P01911 8145819
    7873 1dli:A (2.31) BS01 NAD 1.1.1.22 GO:0000271 ... P0C0F4 10841783
    7874 1dli:A (2.31) BS02 UDX 1.1.1.22 GO:0000271 ... P0C0F4 10841783
    7875 1dlj:A (1.8) BS01 NAI 1.1.1.22 GO:0000271 ... P0C0F4 10841783
    7876 1dlj:A (1.8) BS02 UGA 1.1.1.22 GO:0000271 ... P0C0F4 10841783
    7877 1dlk:B (2.14) BS01 peptide 3.4.21.1 GO:0004252 ... P00766 10713514
    7878 1dlk:B (2.14) BS02 peptide 3.4.21.1 GO:0004252 ... P00766 10713514
    7879 1dlk:B (2.14) BS03 peptide 3.4.21.1 GO:0004252 ... P00766 10713514
    7880 1dlk:D (2.14) BS01 peptide 3.4.21.1 GO:0004252 ... P00766 10713514
    7881 1dlk:D (2.14) BS02 peptide 3.4.21.1 GO:0004252 ... P00766 10713514
    7882 1dll:A (1.8) BS01 BGC 3.4.24.68 GO:0005576 ... P04958 10722735
    7883 1dll:A (1.8) BS02 GAL 3.4.24.68 GO:0005576 ... P04958 10722735
    7884 1dlm:A (2.0) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7885 1dlm:B (2.0) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7886 1dlq:A (2.3) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7887 1dlq:B (2.3) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7888 1dlr:A (2.3) BS01 NDP 1.5.1.3 GO:0000900 ... P00374 7890613
    7889 1dlr:A (2.3) BS02 MXA 1.5.1.3 GO:0000900 ... P00374 7890613 MOAD: Ki=16.4nM
    BindingDB: IC50=0.61nM, Ki=0.025nM
    7890 1dls:A (2.3) BS01 NDP 1.5.1.3 GO:0000900 ... P00374 7890613
    7891 1dls:A (2.3) BS02 MTX 1.5.1.3 GO:0000900 ... P00374 7890613 MOAD: Ki=10.9nM
    BindingDB: IC50=22nM, Kd=0.194984nM, Ki=4420nM, EC50=13.3nM
    7892 1dlt:A (1.9) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7893 1dlt:A (1.9) BS02 CAQ 1.13.11.1 GO:0003824 ... P07773 10801478
    7894 1dlt:B (1.9) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7895 1dlt:B (1.9) BS02 CAQ 1.13.11.1 GO:0003824 ... P07773 10801478
    7896 1dlv:A (2.29) BS01 COA 2.3.1.9 GO:0003985 ... P07097 10764581
    7897 1dlv:B (2.29) BS01 COA 2.3.1.9 GO:0003985 ... P07097 10764581
    7898 1dlv:C (2.29) BS01 COA 2.3.1.9 GO:0003985 ... P07097 10764581
    7899 1dlv:D (2.29) BS01 COA 2.3.1.9 GO:0003985 ... P07097 10764581
    7900 1dlw:A (1.54) BS01 HEM ? GO:0005344 ... P15160 10835341
    7901 1dly:A (1.8) BS01 HEM ? GO:0005344 ... Q08753 10835341
    7902 1dm1:A (1.99) BS01 HEM ? GO:0005344 ... P02210 10694477
    7903 1dm2:A (2.1) BS01 HMD 2.7.11.22 GO:0000082 ... P24941 10662688 PDBbind: -logKd/Ki=7.15, IC50=70nM
    7904 1dm3:A (2.0) BS01 ACO 2.3.1.9 GO:0003985 ... P07097 10764581
    7905 1dm3:B (2.0) BS01 ACO 2.3.1.9 GO:0003985 ... P07097 10764581
    7906 1dm3:C (2.0) BS01 ACO 2.3.1.9 GO:0003985 ... P07097 10764581
    7907 1dm3:D (2.0) BS01 ACO 2.3.1.9 GO:0003985 ... P07097 10764581
    7908 1dm4:B (2.5) BS01 peptide 3.4.21.5 GO:0004252 ... P00734 10739913
    7909 1dm5:A (1.93) BS01 CA ? GO:0005509 ... P26256 10704197
    7910 1dm5:A (1.93) BS02 CA ? GO:0005509 ... P26256 10704197
    7911 1dm5:B (1.93) BS01 CA ? GO:0005509 ... P26256 10704197
    7912 1dm5:B (1.93) BS02 CA ? GO:0005509 ... P26256 10704197
    7913 1dm5:C (1.93) BS01 CA ? GO:0005509 ... P26256 10704197
    7914 1dm5:C (1.93) BS02 CA ? GO:0005509 ... P26256 10704197
    7915 1dm5:D (1.93) BS01 CA ? GO:0005509 ... P26256 10704197
    7916 1dm5:D (1.93) BS02 CA ? GO:0005509 ... P26256 10704197
    7917 1dm5:E (1.93) BS01 CA ? GO:0005509 ... P26256 10704197
    7918 1dm5:E (1.93) BS02 CA ? GO:0005509 ... P26256 10704197
    7919 1dm5:F (1.93) BS01 CA ? GO:0005509 ... P26256 10704197
    7920 1dm6:A (1.95) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 11695891
    7921 1dm6:A (1.95) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 11695891
    7922 1dm6:A (1.95) BS03 PH3 1.14.13.39 GO:0004517 ... P29473 11695891
    7923 1dm6:A (1.95) BS04 PH3 1.14.13.39 GO:0004517 ... P29473 11695891
    7924 1dm6:A (1.95) BS05 PH3 1.14.13.39 GO:0004517 ... P29473 11695891
    7925 1dm6:B (1.95) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 11695891
    7926 1dm6:B (1.95) BS02 PH3 1.14.13.39 GO:0004517 ... P29473 11695891
    7927 1dm6:B (1.95) BS03 PH3 1.14.13.39 GO:0004517 ... P29473 11695891
    7928 1dm6:B (1.95) BS04 HEM 1.14.13.39 GO:0004517 ... P29473 11695891
    7929 1dm6:B (1.95) BS05 PH3 1.14.13.39 GO:0004517 ... P29473 11695891
    7930 1dm7:A (2.1) BS01 HEM 1.14.13.39 GO:0004517 ... P29473 N/A
    7931 1dm7:A (2.1) BS02 HRG 1.14.13.39 GO:0004517 ... P29473 N/A
    7932 1dm7:A (2.1) BS03 ZN 1.14.13.39 GO:0004517 ... P29473 N/A
    7933 1dm7:B (2.1) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 N/A
    7934 1dm7:B (2.1) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 N/A
    7935 1dm7:B (2.1) BS03 HRG 1.14.13.39 GO:0004517 ... P29473 N/A
    7936 1dm8:A (2.25) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 N/A
    7937 1dm8:A (2.25) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 N/A
    7938 1dm8:A (2.25) BS03 H4B 1.14.13.39 GO:0004517 ... P29473 N/A
    7939 1dm8:A (2.25) BS04 TZC 1.14.13.39 GO:0004517 ... P29473 N/A
    7940 1dm8:A (2.25) BS05 H4B 1.14.13.39 GO:0004517 ... P29473 N/A
    7941 1dm8:B (2.25) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 N/A
    7942 1dm8:B (2.25) BS02 H4B 1.14.13.39 GO:0004517 ... P29473 N/A
    7943 1dm8:B (2.25) BS03 HEM 1.14.13.39 GO:0004517 ... P29473 N/A
    7944 1dm8:B (2.25) BS04 H4B 1.14.13.39 GO:0004517 ... P29473 N/A
    7945 1dm8:B (2.25) BS05 TZC 1.14.13.39 GO:0004517 ... P29473 N/A
    7946 1dma:A (2.5) BS01 NCA 2.4.2.36 GO:0047286 ... P11439 7568123
    7947 1dma:B (2.5) BS01 NCA 2.4.2.36 GO:0047286 ... P11439 7568123
    7948 1dma:B (2.5) BS02 AMP 2.4.2.36 GO:0047286 ... P11439 7568123
    7949 1dmb:A (1.8) BS01 GLC ? GO:0005515 ... P0AEX9 8399200
    7950 1dmb:A (1.8) BS02 GLC ? GO:0005515 ... P0AEX9 8399200
    7951 1dmc:A (-1.00) BS01 CD ? GO:0046872 ... P55949 7819257
    7952 1dmc:A (-1.00) BS02 CD ? GO:0046872 ... P55949 7819257
    7953 1dmc:A (-1.00) BS03 CD ? GO:0046872 ... P55949 7819257
    7954 1dmd:A (-1.00) BS01 CD ? GO:0046872 ... P55949 7819257
    7955 1dmd:A (-1.00) BS02 CD ? GO:0046872 ... P55949 7819257
    7956 1dmd:A (-1.00) BS03 CD ? GO:0046872 ... P55949 7819257
    7957 1dmh:A (1.7) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7958 1dmh:A (1.7) BS02 MCT 1.13.11.1 GO:0003824 ... P07773 10801478
    7959 1dmh:B (1.7) BS01 FE 1.13.11.1 GO:0003824 ... P07773 10801478
    7960 1dmh:B (1.7) BS02 MCT 1.13.11.1 GO:0003824 ... P07773 10801478
    7961 1dmi:A (2.0) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 N/A
    7962 1dmi:A (2.0) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 N/A
    7963 1dmi:A (2.0) BS03 BHS 1.14.13.39 GO:0004517 ... P29473 N/A
    7964 1dmi:A (2.0) BS04 BHS 1.14.13.39 GO:0004517 ... P29473 N/A
    7965 1dmi:B (2.0) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 N/A
    7966 1dmi:B (2.0) BS02 BHS 1.14.13.39 GO:0004517 ... P29473 N/A
    7967 1dmi:B (2.0) BS03 HEM 1.14.13.39 GO:0004517 ... P29473 N/A
    7968 1dmi:B (2.0) BS04 BHS 1.14.13.39 GO:0004517 ... P29473 N/A
    7969 1dmi:B (2.0) BS05 ITU 1.14.13.39 GO:0004517 ... P29473 N/A
    7970 1dmj:A (2.35) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 11590164
    7971 1dmj:A (2.35) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 11590164
    7972 1dmj:A (2.35) BS03 AP4 1.14.13.39 GO:0004517 ... P29473 11590164
    7973 1dmj:A (2.35) BS04 ITU 1.14.13.39 GO:0004517 ... P29473 11590164
    7974 1dmj:A (2.35) BS05 AP4 1.14.13.39 GO:0004517 ... P29473 11590164
    7975 1dmj:B (2.35) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 11590164
    7976 1dmj:B (2.35) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 11590164
    7977 1dmj:B (2.35) BS03 AP4 1.14.13.39 GO:0004517 ... P29473 11590164
    7978 1dmj:B (2.35) BS04 ITU 1.14.13.39 GO:0004517 ... P29473 11590164
    7979 1dmk:A (1.9) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 11590164
    7980 1dmk:A (1.9) BS02 HEM 1.14.13.39 GO:0004517 ... P29473 11590164
    7981 1dmk:A (1.9) BS03 AP6 1.14.13.39 GO:0004517 ... P29473 11590164
    7982 1dmk:A (1.9) BS04 ITU 1.14.13.39 GO:0004517 ... P29473 11590164
    7983 1dmk:A (1.9) BS05 AP6 1.14.13.39 GO:0004517 ... P29473 11590164
    7984 1dmk:B (1.9) BS01 ZN 1.14.13.39 GO:0004517 ... P29473 11590164
    7985 1dmk:B (1.9) BS02 AP6 1.14.13.39 GO:0004517 ... P29473 11590164
    7986 1dmk:B (1.9) BS03 HEM 1.14.13.39 GO:0004517 ... P29473 11590164
    7987 1dmk:B (1.9) BS04 AP6 1.14.13.39 GO:0004517 ... P29473 11590164
    7988 1dmk:B (1.9) BS05 ITU 1.14.13.39 GO:0004517 ... P29473 11590164
    7989 1dmp:A (2.0) BS01 DMQ 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 ... P04585 8807858 PDBbind: -logKd/Ki=9.55, Ki=0.28nM
    7990 1dmp:B (2.0) BS01 DMQ 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 ... P04585 8807858 MOAD: Ki=0.28nM
    PDBbind: -logKd/Ki=9.55, Ki=0.28nM
    7991 1dmr:A (1.82) BS01 PGD 1.7.2.3
    1.8.5.3
    GO:0016491 ... Q52675 N/A
    7992 1dmr:A (1.82) BS02 PGD 1.7.2.3
    1.8.5.3
    GO:0016491 ... Q52675 N/A
    7993 1dms:A (1.88) BS01 PGD 1.7.2.3
    1.8.5.3
    GO:0009033 ... Q52675 8890912
    7994 1dms:A (1.88) BS02 PGD 1.7.2.3
    1.8.5.3
    GO:0009033 ... Q52675 8890912
    7995 1dms:A (1.88) BS03 2MO 1.7.2.3
    1.8.5.3
    GO:0009033 ... Q52675 8890912
    7996 1dmt:A (2.1) BS01 ZN 3.4.24.11 GO:0001786 ... P08473 10669592
    7997 1dmt:A (2.1) BS02 RDF 3.4.24.11 GO:0001786 ... P08473 10669592 PDBbind: -logKd/Ki=8.70, IC50=2nM
    BindingDB: IC50=30nM
    7998 1dmu:A (2.2) BS01 dna 3.1.21.4 GO:0004519 ... O68557 9736624
    7999 1dmu:A (2.2) BS02 CA 3.1.21.4 GO:0004519 ... O68557 9736624
    8000 1dmu:A (2.2) BS03 CA 3.1.21.4 GO:0004519 ... O68557 9736624

    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)(download the PDF file).
  • 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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