Ligand ID | Ligand short name | Ligand long name | PDB ID | PDB name | mutLBS |
36S | | 2-{4-[3-CHLORO-2-(2-METHOXYPHENYL)-1H-INDOL-5- YL]PIPERIDIN-1-YL}-N-METHYLETHANAMINE | 4qpp | A | L162 L343 R351 | 36S | | 2-{4-[3-CHLORO-2-(2-METHOXYPHENYL)-1H-INDOL-5- YL]PIPERIDIN-1-YL}-N-METHYLETHANAMINE | 4qpp | B | L162 L343 R351 | 36S | | 2-{4-[3-CHLORO-2-(2-METHOXYPHENYL)-1H-INDOL-5- YL]PIPERIDIN-1-YL}-N-METHYLETHANAMINE | 4qpp | C | L162 L343 R351 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4hc4 | A | M60 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4qpp | A | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4qpp | B | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4qpp | C | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4y2h | A | M60 E155 | 49K | | N-{[5-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]METHYL}-N- METHYLETHANE-1,2-DIAMINE | 4y2h | A | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4y2h | B | M60 E155 | 49K | | N-{[5-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]METHYL}-N- METHYLETHANE-1,2-DIAMINE | 4y2h | B | M60 E155 | 49L | | N,N'-DIMETHYL-N-({3-[4-({TRANS-3-[2-(TETRAHYDRO-2H- PYRAN-4-YL)ETHOXY]CYCLOBUTYL}OXY)PHENYL]-1H-PYRAZOL-4- YL}METHYL)ETHANE-1,2-DIAMINE | 4y30 | A | M60 E155 | 49L | | N,N'-DIMETHYL-N-({3-[4-({TRANS-3-[2-(TETRAHYDRO-2H- PYRAN-4-YL)ETHOXY]CYCLOBUTYL}OXY)PHENYL]-1H-PYRAZOL-4- YL}METHYL)ETHANE-1,2-DIAMINE | 4y30 | B | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 5e8r | A | M60 E155 | 5L6 | | N-METHYL-N-({4-[4-(PROPAN-2-YLOXY)PHENYL]-1H-PYRROL-3- YL}METHYL)ETHANE-1,2-DIAMINE | 5e8r | A | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 5e8r | B | M60 E155 | 5L6 | | N-METHYL-N-({4-[4-(PROPAN-2-YLOXY)PHENYL]-1H-PYRROL-3- YL}METHYL)ETHANE-1,2-DIAMINE | 5e8r | B | M60 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4y30 | A | M60 G138 E155 | SAH | | S-ADENOSYL-L-HOMOCYSTEINE | 4y30 | B | M60 G138 E155 | III | | Peptide ligand (UNK,UNK,UNK,UNK,UNK) | 4qpp | C | W203 V237 | III | | Peptide ligand (UNK,UNK,UNK,UNK,UNK) | 4qpp | B | W203 V237 Y324 |
LBS | AA sequence | # species | Species |
A113 | VYAVEASAIWQ | 2 | Homo sapiens, Mus musculus | A113 | VYAVDASDIAV | 1 | Arabidopsis thaliana | A113 | VYAVDASDIAL | 1 | Oryza sativa subsp. japonica | A113 | VYAVEASSMSQ | 1 | Xenopus tropicalis | A113 | VYAVEASDIWQ | 1 | Bos taurus | A91 | VLDVGAGTGIL | 4 | Homo sapiens, Xenopus tropicalis, Mus musculus, Bos taurus | A91 | VVDVGCGTGIL | 1 | Arabidopsis thaliana | A91 | VLDVGCGTGVL | 1 | Oryza sativa subsp. japonica | C50 | QLYYECYSDVS | 2 | Homo sapiens, Mus musculus | C50 | VAYFHSYAHVG | 1 | Arabidopsis thaliana | C50 | MAYFKAYSHIG | 1 | Oryza sativa subsp. japonica | C50 | CEYFQCYSDVS | 1 | Xenopus tropicalis | C50 | QLYYQCYSDVS | 1 | Bos taurus | E112 | RVYAVEASAIW | 2 | Homo sapiens, Mus musculus | E112 | RVYAVDASDIA | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | E112 | AVYAVEASSMS | 1 | Xenopus tropicalis | E112 | RVYAVEASDIW | 1 | Bos taurus | E141 | LPGPVETVELP | 3 | Homo sapiens, Mus musculus, Bos taurus | E141 | LHGRVEDVEID | 1 | Arabidopsis thaliana | E141 | LHGRIEDVEIE | 1 | Oryza sativa subsp. japonica | E141 | LNSSVESAEIP | 1 | Xenopus tropicalis | E155 | DAIVSEWMGYG | 2 | Homo sapiens, Mus musculus | E155 | DVIISEWMGYM | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | E155 | DAIVSEWMGYA | 1 | Xenopus tropicalis | E155 | DAIVSEWMGCG | 1 | Bos taurus | E164 | YGLLHESMLSS | 2 | Homo sapiens, Mus musculus | E164 | YMLLYESMLGS | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | E164 | YALMYESMLPS | 1 | Xenopus tropicalis | E164 | CGLLHESMLSS | 1 | Bos taurus | E264 | ARAGLEQELEA | 2 | Mus musculus, Bos taurus | E264 | SRAGLEQELEA | 1 | Homo sapiens | E264 | CKTIKIQELDS | 1 | Arabidopsis thaliana | E264 | CYTIQAPELET | 1 | Oryza sativa subsp. japonica | E264 | NVCTQE-EVRN | 1 | Xenopus tropicalis | E59 | VSVHEEMIADR | 2 | Homo sapiens, Bos taurus | E59 | VGIHEEMIKDR | 1 | Arabidopsis thaliana | E59 | IGVHEEMLKDH | 1 | Oryza sativa subsp. japonica | E59 | VSVHEEMIADT | 1 | Xenopus tropicalis | E59 | VSVHEEMIADQ | 1 | Mus musculus | G138 | VHVLPGPVETV | 3 | Homo sapiens, Mus musculus, Bos taurus | G138 | VIVLHGRVEDV | 1 | Arabidopsis thaliana | G138 | VIVLHGRIEDV | 1 | Oryza sativa subsp. japonica | G138 | VKVLNSSVESA | 1 | Xenopus tropicalis | G90 | TVLDVGAGTGI | 4 | Homo sapiens, Xenopus tropicalis, Mus musculus, Bos taurus | G90 | VVVDVGCGTGI | 1 | Arabidopsis thaliana | G90 | VVLDVGCGTGV | 1 | Oryza sativa subsp. japonica | G92 | LDVGAGTGILS | 4 | Homo sapiens, Xenopus tropicalis, Mus musculus, Bos taurus | G92 | VDVGCGTGILS | 1 | Arabidopsis thaliana | G92 | LDVGCGTGVLS | 1 | Oryza sativa subsp. japonica | H163 | GYGLLHESMLS | 2 | Homo sapiens, Mus musculus | H163 | GYMLLYESMLG | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | H163 | GYALMYESMLP | 1 | Xenopus tropicalis | H163 | GCGLLHESMLS | 1 | Bos taurus | H233 | RCLMGHSEIVV | 3 | Homo sapiens, Mus musculus, Bos taurus | H233 | QCAF--EEPSV | 1 | Arabidopsis thaliana | H233 | QCAF--MEPSV | 1 | Oryza sativa subsp. japonica | H233 | SCIM-NKEMAV | 1 | Xenopus tropicalis | H317 | FHPATHWKQAL | 2 | Homo sapiens, Mus musculus | H317 | ESPPTHWQQTI | 1 | Arabidopsis thaliana | H317 | EDAPTHWQQTL | 1 | Oryza sativa subsp. japonica | H317 | YGEETHWKQTL | 1 | Xenopus tropicalis | H317 | FHPVTHWKQAL | 1 | Bos taurus | H57 | SDVSVHEEMIA | 4 | Homo sapiens, Xenopus tropicalis, Mus musculus, Bos taurus | H57 | AHVGIHEEMIK | 1 | Arabidopsis thaliana | H57 | SHIGVHEEMLK | 1 | Oryza sativa subsp. japonica | I95 | GAGTGILSIFC | 3 | Homo sapiens, Mus musculus, Bos taurus | I95 | GCGTGILSIFC | 1 | Arabidopsis thaliana | I95 | GCGTGVLSIFC | 1 | Oryza sativa subsp. japonica | I95 | GAGTGILSVFS | 1 | Xenopus tropicalis | L162 | MGYGLLHESML | 2 | Homo sapiens, Mus musculus | L162 | MGYMLLYESML | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | L162 | MGYALMYESML | 1 | Xenopus tropicalis | L162 | MGCGLLHESML | 1 | Bos taurus | L267 | GLEQELEAGVG | 3 | Homo sapiens, Mus musculus, Bos taurus | L267 | IKIQELDS-VT | 1 | Arabidopsis thaliana | L267 | IQAPELET-IT | 1 | Oryza sativa subsp. japonica | L267 | TQE-EVRN-LH | 1 | Xenopus tropicalis | L343 | SGEITLLPSRD | 1 | Homo sapiens | L343 | EGSVTLSQSKE | 1 | Arabidopsis thaliana | L343 | EGSVTISQSQQ | 1 | Oryza sativa subsp. japonica | L343 | TGDVTLSPSDI | 1 | Xenopus tropicalis | L343 | SGEITLLPSPD | 1 | Mus musculus | L343 | SGEITLLPSQD | 1 | Bos taurus | L344 | GEITLLPSRDN | 1 | Homo sapiens | L344 | GSVTLSQSKEN | 1 | Arabidopsis thaliana | L344 | GSVTISQSQQH | 1 | Oryza sativa subsp. japonica | L344 | GDVTLSPSDIN | 1 | Xenopus tropicalis | L344 | GEITLLPSPDN | 1 | Mus musculus | L344 | GEITLLPSQDH | 1 | Bos taurus | L353 | DNPRRLRVLLR | 1 | Homo sapiens | L353 | ENKRFMNIHLE | 1 | Arabidopsis thaliana | L353 | QHARFLNICLK | 1 | Oryza sativa subsp. japonica | L353 | INPRHLRVLLN | 1 | Xenopus tropicalis | L353 | DNPRRLRILLR | 1 | Mus musculus | L353 | DHHRHLRVLLR | 1 | Bos taurus | L46 | RERDQLYYECY | 1 | Homo sapiens | L46 | TDFDVAYFHSY | 1 | Arabidopsis thaliana | L46 | TDYDMAYFKAY | 1 | Oryza sativa subsp. japonica | L46 | TEQDCEYFQCY | 1 | Xenopus tropicalis | L46 | SERDQLYYECY | 1 | Mus musculus | L46 | RERDQLYYQCY | 1 | Bos taurus | L96 | AGTGILSIFCA | 3 | Homo sapiens, Mus musculus, Bos taurus | L96 | CGTGILSIFCA | 1 | Arabidopsis thaliana | L96 | CGTGVLSIFCA | 1 | Oryza sativa subsp. japonica | L96 | AGTGILSVFSV | 1 | Xenopus tropicalis | M157 | IVSEWMGYGLL | 2 | Homo sapiens, Mus musculus | M157 | IISEWMGYMLL | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | M157 | IVSEWMGYALM | 1 | Xenopus tropicalis | M157 | IVSEWMGCGLL | 1 | Bos taurus | M166 | LLHESMLSSVL | 3 | Homo sapiens, Mus musculus, Bos taurus | M166 | LLYESMLGSVI | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | M166 | LMYESMLPSVI | 1 | Xenopus tropicalis | M200 | ISD-QMLEWRL | 2 | Homo sapiens, Mus musculus | M200 | ISHPDRYSHSI | 1 | Arabidopsis thaliana | M200 | ITNSHRYQDSV | 1 | Oryza sativa subsp. japonica | M200 | VND-LIVESRL | 1 | Xenopus tropicalis | M200 | ISD-QMLELRL | 1 | Bos taurus | M60 | SVHEEMIADRV | 2 | Homo sapiens, Bos taurus | M60 | GIHEEMIKDRA | 1 | Arabidopsis thaliana | M60 | GVHEEMLKDHV | 1 | Oryza sativa subsp. japonica | M60 | SVHEEMIADTV | 1 | Xenopus tropicalis | M60 | SVHEEMIADQV | 1 | Mus musculus | N349 | LPSRDNPRRLR | 1 | Homo sapiens | N349 | SQSKENKRFMN | 1 | Arabidopsis thaliana | N349 | SQSQQHARFLN | 1 | Oryza sativa subsp. japonica | N349 | SPSDINPRHLR | 1 | Xenopus tropicalis | N349 | LPSPDNPRRLR | 1 | Mus musculus | N349 | LPSQDHHRHLR | 1 | Bos taurus | P139 | HVLPGPVETVE | 3 | Homo sapiens, Mus musculus, Bos taurus | P139 | IVLHGRVEDVE | 1 | Arabidopsis thaliana | P139 | IVLHGRIEDVE | 1 | Oryza sativa subsp. japonica | P139 | KVLNSSVESAE | 1 | Xenopus tropicalis | P345 | EITLLPSRDNP | 1 | Homo sapiens | P345 | SVTLSQSKENK | 1 | Arabidopsis thaliana | P345 | SVTISQSQQHA | 1 | Oryza sativa subsp. japonica | P345 | DVTLSPSDINP | 1 | Xenopus tropicalis | P345 | EITLLPSPDNP | 1 | Mus musculus | P345 | EITLLPSQDHH | 1 | Bos taurus | P350 | PSRDNPRRLRV | 1 | Homo sapiens | P350 | QSKENKRFMNI | 1 | Arabidopsis thaliana | P350 | QSQQHARFLNI | 1 | Oryza sativa subsp. japonica | P350 | PSDINPRHLRV | 1 | Xenopus tropicalis | P350 | PSPDNPRRLRI | 1 | Mus musculus | P350 | PSQDHHRHLRV | 1 | Bos taurus | Q239 | SEIVVQGLSGE | 2 | Homo sapiens, Bos taurus | Q239 | EEPSVESISGE | 1 | Arabidopsis thaliana | Q239 | MEPSVETISGE | 1 | Oryza sativa subsp. japonica | Q239 | KEMAVNLVSPE | 1 | Xenopus tropicalis | Q239 | SEIVVQDLSGE | 1 | Mus musculus | R204 | QMLEWRLGFWS | 2 | Homo sapiens, Mus musculus | R204 | DRYSHSIDFWR | 1 | Arabidopsis thaliana | R204 | HRYQDSVYFWQ | 1 | Oryza sativa subsp. japonica | R204 | LIVESRLDFWS | 1 | Xenopus tropicalis | R204 | QMLELRLSFWS | 1 | Bos taurus | R351 | SRDNPRRLRVL | 1 | Homo sapiens | R351 | SKENKRFMNIH | 1 | Arabidopsis thaliana | R351 | SQQHARFLNIC | 1 | Oryza sativa subsp. japonica | R351 | SDINPRHLRVL | 1 | Xenopus tropicalis | R351 | SPDNPRRLRIL | 1 | Mus musculus | R351 | SQDHHRHLRVL | 1 | Bos taurus | R352 | RDNPRRLRVLL | 1 | Homo sapiens | R352 | KENKRFMNIHL | 1 | Arabidopsis thaliana | R352 | QQHARFLNICL | 1 | Oryza sativa subsp. japonica | R352 | DINPRHLRVLL | 1 | Xenopus tropicalis | R352 | PDNPRRLRILL | 1 | Mus musculus | R352 | QDHHRHLRVLL | 1 | Bos taurus | R43 | RTKRERDQLYY | 1 | Homo sapiens | R43 | PPCTDFDVAYF | 1 | Arabidopsis thaliana | R43 | PPCTDYDMAYF | 1 | Oryza sativa subsp. japonica | R43 | --RTEQDCEYF | 1 | Xenopus tropicalis | R43 | RTKSERDQLYY | 1 | Mus musculus | R43 | RTRRERDQLYY | 1 | Bos taurus | R66 | IADRVRTDAYR | 2 | Homo sapiens, Bos taurus | R66 | IKDRARTETYR | 1 | Arabidopsis thaliana | R66 | LKDHVRTNTYR | 1 | Oryza sativa subsp. japonica | R66 | IADTVRTNAYK | 1 | Xenopus tropicalis | R66 | IADQVRTEAYR | 1 | Mus musculus | S114 | YAVEASAIWQQ | 2 | Homo sapiens, Mus musculus | S114 | YAVDASDIAVQ | 1 | Arabidopsis thaliana | S114 | YAVDASDIALQ | 1 | Oryza sativa subsp. japonica | S114 | YAVEASSMSQL | 1 | Xenopus tropicalis | S114 | YAVEASDIWQQ | 1 | Bos taurus | S168 | HESMLSSVLHA | 3 | Homo sapiens, Mus musculus, Bos taurus | S168 | YESMLGSVITA | 1 | Arabidopsis thaliana | S168 | YESMLGSVIFA | 1 | Oryza sativa subsp. japonica | S168 | YESMLPSVIYA | 1 | Xenopus tropicalis | S169 | ESMLSSVLHAR | 3 | Homo sapiens, Mus musculus, Bos taurus | S169 | ESMLGSVITAR | 1 | Arabidopsis thaliana | S169 | ESMLGSVIFAR | 1 | Oryza sativa subsp. japonica | S169 | ESMLPSVIYAR | 1 | Xenopus tropicalis | V140 | VLPGPVETVEL | 3 | Homo sapiens, Mus musculus, Bos taurus | V140 | VLHGRVEDVEI | 1 | Arabidopsis thaliana | V140 | VLHGRIEDVEI | 1 | Oryza sativa subsp. japonica | V140 | VLNSSVESAEI | 1 | Xenopus tropicalis | V237 | GHSEIVVQGLS | 2 | Homo sapiens, Bos taurus | V237 | --EEPSVESIS | 1 | Arabidopsis thaliana | V237 | --MEPSVETIS | 1 | Oryza sativa subsp. japonica | V237 | -NKEMAVNLVS | 1 | Xenopus tropicalis | V237 | GHSEIVVQDLS | 1 | Mus musculus | V56 | YSDVSVHEEMI | 4 | Homo sapiens, Xenopus tropicalis, Mus musculus, Bos taurus | V56 | YAHVGIHEEMI | 1 | Arabidopsis thaliana | V56 | YSHIGVHEEML | 1 | Oryza sativa subsp. japonica | W156 | AIVSEWMGYGL | 2 | Homo sapiens, Mus musculus | W156 | VIISEWMGYML | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | W156 | AIVSEWMGYAL | 1 | Xenopus tropicalis | W156 | AIVSEWMGCGL | 1 | Bos taurus | W203 | -QMLEWRLGFW | 2 | Homo sapiens, Mus musculus | W203 | PDRYSHSIDFW | 1 | Arabidopsis thaliana | W203 | SHRYQDSVYFW | 1 | Oryza sativa subsp. japonica | W203 | -LIVESRLDFW | 1 | Xenopus tropicalis | W203 | -QMLELRLSFW | 1 | Bos taurus | W318 | HPATHWKQALL | 2 | Homo sapiens, Mus musculus | W318 | SPPTHWQQTIV | 1 | Arabidopsis thaliana | W318 | DAPTHWQQTLL | 1 | Oryza sativa subsp. japonica | W318 | GEETHWKQTLL | 1 | Xenopus tropicalis | W318 | HPVTHWKQALL | 1 | Bos taurus | Y159 | SEWMGYGLLHE | 2 | Homo sapiens, Mus musculus | Y159 | SEWMGYMLLYE | 2 | Arabidopsis thaliana, Oryza sativa subsp. japonica | Y159 | SEWMGYALMYE | 1 | Xenopus tropicalis | Y159 | SEWMGCGLLHE | 1 | Bos taurus | Y324 | KQALLYLNEPV | 3 | Homo sapiens, Mus musculus, Bos taurus | Y324 | QQTIVYFYDPI | 1 | Arabidopsis thaliana | Y324 | QQTLLYLFEPI | 1 | Oryza sativa subsp. japonica | Y324 | KQTLLYLDEEV | 1 | Xenopus tropicalis | Y47 | ERDQLYYECYS | 2 | Homo sapiens, Mus musculus | Y47 | DFDVAYFHSYA | 1 | Arabidopsis thaliana | Y47 | DYDMAYFKAYS | 1 | Oryza sativa subsp. japonica | Y47 | EQDCEYFQCYS | 1 | Xenopus tropicalis | Y47 | ERDQLYYQCYS | 1 | Bos taurus | Y48 | RDQLYYECYSD | 2 | Homo sapiens, Mus musculus | Y48 | FDVAYFHSYAH | 1 | Arabidopsis thaliana | Y48 | YDMAYFKAYSH | 1 | Oryza sativa subsp. japonica | Y48 | QDCEYFQCYSD | 1 | Xenopus tropicalis | Y48 | RDQLYYQCYSD | 1 | Bos taurus | Y51 | LYYECYSDVSV | 2 | Homo sapiens, Mus musculus | Y51 | AYFHSYAHVGI | 1 | Arabidopsis thaliana | Y51 | AYFKAYSHIGV | 1 | Oryza sativa subsp. japonica | Y51 | EYFQCYSDVSV | 1 | Xenopus tropicalis | Y51 | LYYQCYSDVSV | 1 | Bos taurus |