cf) Cancer type abbreviation. BLCA: Bladder urothelial carcinoma, BRCA: Breast invasive carcinoma, CESC: Cervical squamous cell carcinoma and endocervical adenocarcinoma, COAD: Colon adenocarcinoma, GBM: Glioblastoma multiforme, LGG: Brain lower grade glioma, HNSC: Head and neck squamous cell carcinoma, KICH: Kidney chromophobe, KIRC: Kidney renal clear cell carcinoma, KIRP: Kidney renal papillary cell carcinoma, LAML: Acute myeloid leukemia, LUAD: Lung adenocarcinoma, LUSC: Lung squamous cell carcinoma, OV: Ovarian serous cystadenocarcinoma, PAAD: Pancreatic adenocarcinoma, PRAD: Prostate adenocarcinoma, SKCM: Skin cutaneous melanoma, STAD: Stomach adenocarcinoma, THCA: Thyroid carcinoma, UCEC: Uterine corpus endometrial carcinoma. |
Ligand ID | Ligand short name | Ligand long name | PDB ID | PDB name | mutLBS |
A9M | | N-(2-HYDROXYETHYL)ICOSANAMIDE | 4azr | B | C43 | T4B | | ((2'-(5-ETHYL-3,4-DIPHENYL-1H-PYRAZOL-1-YL)-3-BIPHENYLYL)OXY)ACETIC ACID | 4azm | A | C43 T56 | A9M | | N-(2-HYDROXYETHYL)ICOSANAMIDE | 4azr | A | C43 T56 | PLM | | PALMITIC ACID | 1b56 | A | I107 V118 R129 Y131 | T4B | | ((2'-(5-ETHYL-3,4-DIPHENYL-1H-PYRAZOL-1-YL)-3-BIPHENYLYL)OXY)ACETIC ACID | 4azm | B | I54 T56 | A9M | | N-(2-HYDROXYETHYL)ICOSANAMIDE | 4azr | B | R129 Y131 | EIC | | LINOLEIC ACID | 4lkt | A | R129 Y131 | EIC | | LINOLEIC ACID | 4lkt | B | R129 Y131 | EIC | | LINOLEIC ACID | 4lkt | D | T56 I107 V118 R129 Y131 | EIC | | LINOLEIC ACID | 4lkt | C | T56 V118 R129 Y131 | T4B | | ((2'-(5-ETHYL-3,4-DIPHENYL-1H-PYRAZOL-1-YL)-3-BIPHENYLYL)OXY)ACETIC ACID | 4azm | A | V118 R129 Y131 | T4B | | ((2'-(5-ETHYL-3,4-DIPHENYL-1H-PYRAZOL-1-YL)-3-BIPHENYLYL)OXY)ACETIC ACID | 4azm | B | V118 R129 Y131 | A9M | | N-(2-HYDROXYETHYL)ICOSANAMIDE | 4azr | A | V118 R129 Y131 |
LBS | AA sequence | # species | Species |
A39 | KMGAMAKPDCI | 2 | Homo sapiens, Rattus norvegicus | A39 | KVGAMAKPDCI | 1 | Bos taurus | A39 | KMAAMAKPDCI | 1 | Mus musculus | A78 | FEETTADGRKT | 2 | Homo sapiens, Bos taurus | A78 | FDETTADGRKT | 2 | Mus musculus, Rattus norvegicus | C120 | KLVVECVMNNV | 1 | Homo sapiens | C120 | KLVVVCVMNNV | 1 | Bos taurus | C120 | KMIVECVMNNA | 1 | Mus musculus | C120 | KMVVECVMNNA | 1 | Rattus norvegicus | C127 | MNNVTCTRIYE | 1 | Homo sapiens | C127 | MNNVTCTRVYE | 1 | Bos taurus | C127 | MNNATCTRVYE | 1 | Mus musculus | C127 | MNNAICTRVYE | 1 | Rattus norvegicus | C43 | MAKPDCIITCD | 2 | Homo sapiens, Mus musculus | C43 | MAKPDCIITSD | 1 | Bos taurus | C43 | MAKPDCIITLD | 1 | Rattus norvegicus | D79 | EETTADGRKTQ | 2 | Homo sapiens, Bos taurus | D79 | DETTADGRKTE | 2 | Mus musculus, Rattus norvegicus | F19 | VDSKGFDEYMK | 1 | Homo sapiens | F19 | VESKGFDEYMK | 1 | Bos taurus | F19 | MESHGFEEYMK | 1 | Mus musculus | F19 | VESHGFEDYMK | 1 | Rattus norvegicus | G36 | ALRKMGAMAKP | 2 | Homo sapiens, Rattus norvegicus | G36 | ALRKVGAMAKP | 1 | Bos taurus | G36 | ALRKMAAMAKP | 1 | Mus musculus | I107 | GKESTITRKLK | 3 | Homo sapiens, Mus musculus, Rattus norvegicus | I107 | GKESTITRKLE | 1 | Bos taurus | I54 | GKNLTIKTEST | 1 | Homo sapiens | I54 | GKNLSIKTEST | 1 | Bos taurus | I54 | GNNITVKTEST | 1 | Mus musculus | I54 | GNNLTVKTEST | 1 | Rattus norvegicus | K61 | TESTLKTTQFS | 2 | Homo sapiens, Bos taurus | K61 | TESTVKTTVFS | 2 | Mus musculus, Rattus norvegicus | L26 | EYMKELGVGIA | 1 | Homo sapiens | L26 | EYMKEVGVGMA | 1 | Bos taurus | L26 | EYMKELGVGLA | 1 | Mus musculus | L26 | DYMKELGVGLA | 1 | Rattus norvegicus | L32 | GVGIALRKMGA | 1 | Homo sapiens | L32 | GVGMALRKVGA | 1 | Bos taurus | L32 | GVGLALRKMAA | 1 | Mus musculus | L32 | GVGLALRKMGA | 1 | Rattus norvegicus | L60 | KTESTLKTTQF | 2 | Homo sapiens, Bos taurus | L60 | KTESTVKTTVF | 2 | Mus musculus, Rattus norvegicus | M23 | GFDEYMKELGV | 1 | Homo sapiens | M23 | GFDEYMKEVGV | 1 | Bos taurus | M23 | GFEEYMKELGV | 1 | Mus musculus | M23 | GFEDYMKELGV | 1 | Rattus norvegicus | M35 | IALRKMGAMAK | 1 | Homo sapiens | M35 | MALRKVGAMAK | 1 | Bos taurus | M35 | LALRKMAAMAK | 1 | Mus musculus | M35 | LALRKMGAMAK | 1 | Rattus norvegicus | P41 | GAMAKPDCIIT | 3 | Homo sapiens, Bos taurus, Rattus norvegicus | P41 | AAMAKPDCIIT | 1 | Mus musculus | Q64 | TLKTTQFSCTL | 1 | Homo sapiens | Q64 | TLKTTQFSCKL | 1 | Bos taurus | Q64 | TVKTTVFSCNL | 1 | Mus musculus | Q64 | TVKTTVFSCTL | 1 | Rattus norvegicus | R109 | ESTITRKLKDG | 3 | Homo sapiens, Mus musculus, Rattus norvegicus | R109 | ESTITRKLEDG | 1 | Bos taurus | R129 | NVTCTRIYEKV | 1 | Homo sapiens | R129 | NVTCTRVYEKV | 1 | Bos taurus | R129 | NATCTRVYEKV | 1 | Mus musculus | R129 | NAICTRVYEKV | 1 | Rattus norvegicus | R81 | TTADGRKTQTV | 2 | Homo sapiens, Bos taurus | R81 | TTADGRKTETV | 2 | Mus musculus, Rattus norvegicus | T56 | NLTIKTESTLK | 1 | Homo sapiens | T56 | NLSIKTESTLK | 1 | Bos taurus | T56 | NITVKTESTVK | 1 | Mus musculus | T56 | NLTVKTESTVK | 1 | Rattus norvegicus | V118 | DGKLVVECVMN | 1 | Homo sapiens | V118 | DGKLVVVCVMN | 1 | Bos taurus | V118 | DGKMIVECVMN | 1 | Mus musculus | V118 | DGKMVVECVMN | 1 | Rattus norvegicus | Y131 | TCTRIYEKVE | 1 | Homo sapiens | Y131 | TCTRVYEKVE | 1 | Bos taurus | Y131 | TCTRVYEKVQ | 1 | Mus musculus | Y131 | ICTRVYEKVQ | 1 | Rattus norvegicus | Y22 | KGFDEYMKELG | 1 | Homo sapiens | Y22 | KGFDEYMKEVG | 1 | Bos taurus | Y22 | HGFEEYMKELG | 1 | Mus musculus | Y22 | HGFEDYMKELG | 1 | Rattus norvegicus |