Atome 2 : Comparative Modeling, Annotation & Complexes Prediction of Study :
GPCR_HUMAN_201601 (GPCR_HUMAN - Jan 2016)

Download : Data.csv | 3D Models


Tab legend :
    Full name of ligand selected in the comparative docking column:

    General color information : Quality: [ Good | Correct | Uncertain ]
QueryStructural Alignment (SA)3D Modeling AnnotationLigands from PDB templatesPredicted Complexes - pKd:[ ‹nMol | ‹μMol | ‹mMol ]




 Query Sequence
Filter: 		Significants
SA found		 Seq Ident. 3D Core
(QMean Score)		 Classification code

 Binding Site Ligands Found
(Procognate)		 Profile Complexes by comparative docking
(ligands from PDB templates)

 Targets
for screening


Sort by entries

 [Nb of SA]
 [Best Ident]
 [Best Score]
 Main Code
 [Name]
 [Number]
 [Number]
 Distribution of CDocking pKd
 [Number]
100AGRL1_HUMAN15 97% 0.609 PF02793 2 - (0)1 - / - / - 0
101PSYR_HUMAN20 32% 0.265 PF00001 62 - (0)1 - / - / - 0
102ACM2_HUMAN19 97% 0.222 PF00001 C9_S1106 - (0)1 - / - / 1 0
103NPY2R_HUMAN20 38% 0.347 PF00001 82 - (0)1 - / - / - 0
104VIPR2_HUMAN9 46% 0.350 PF00001 15 - (0)1 - / - / - 0
105OPN3_HUMAN20 32% 0.282 PF10413 80 - (0)1 - / - / - 0
106BAI1_HUMAN12 64% 0.409 PF00090 13 - (0)1 - / - / - 0
107HRH2_HUMAN21 38% 0.299 PF00001 237 - (0)1 - / - / - 0
108O10AC_HUMAN10 31% 0.322 PF00001 16 - (0)? - / - / - 0
109O10R2_HUMAN12 33% 0.278 PF00001 25 - (0)? - / - / - 0
110NK3R_HUMAN20 70% 0.259 PF00001 33 - (0)? - / - / - 0
111OR6K6_HUMAN12 59% 0.328 PF00001 31 - (0)? - / - / - 0
112O2AP1_HUMAN3 43% 0.335 PF00001 41 - (0)? - / - / - 0
113CXCR6_HUMAN20 47% 0.284 PF00001 73 - (0)? - / - / - 0
114PAR2_HUMAN18 36% 0.249 PF00001 59 - (0)? - / - / - 0
115MRGX3_HUMAN11 36% 0.176 PF00001 55 - (0)? - / - / - 0
116OR4D1_HUMAN3 32% 0.302 PF00001 28 - (0)? - / - / - 0
117O51V1_HUMAN12 39% 0.225 PF00001 40 - (0)? - / - / - 0
118QRFPR_HUMAN20 31% 0.253 PF00001 45 - (0)? - / - / - 0
119OR3A2_HUMAN4 45% 0.153 PF00001 78 - (0)? - / - / - 0
120GP149_HUMAN11 40% 0.296 PF02162 22 - (0)? - / - / - 0
121OR1A2_HUMAN6 31% 0.259 PF00001 51 - (0)? - / - / - 0
122GRPR_HUMAN20 36% 0.216 PF00001 39 - (0)? - / - / - 0
123OR1A1_HUMAN5 33% 0.215 PF00001 58 - (0)? - / - / - 0
124OR5R1_HUMAN12 28% 0.320 PF00001 52 - (0)? - / - / - 0
125OR4F4_HUMAN7 36% 0.182 PF00001 34 - (0)? - / - / - 0
126O2T10_HUMAN3 33% 0.254 PF00001 94 - (0)? - / - / - 0
127OR4D2_HUMAN5 27% 0.332 PF00001 50 - (0)? - / - / - 0
128O52E2_HUMAN11 31% 0.270 PF00001 37 - (0)? - / - / - 0
129GPR52_HUMAN20 37% 0.293 PF00001 110 - (0)? - / - / - 0
130OR2T3_HUMAN4 45% 0.357 PF00001 44 - (0)? - / - / - 0
131OR1E1_HUMAN5 27% 0.344 PF00001 40 - (0)? - / - / - 0
132OR5A2_HUMAN13 33% 0.313 PF00001 20 - (0)? - / - / - 0
133OR2A5_HUMAN7 36% 0.313 PF00001 48 - (0)? - / - / - 0
134T2R16_HUMAN11 32% 0.301 PF00001 11 - (0)? - / - / - 0
135OR2BB_HUMAN0 33% 0.283 PF00001 69 - (0)? - / - / - 0
136GPR56_HUMAN11 27% 0.047 PF00001 13 - (0)? - / - / - 0
137MRGRD_HUMAN14 40% 0.212 PF00001 36 - (0)? - / - / - 0
138AGRD2_HUMAN8 29% 0.417 PF07952 12 - (0)? - / - / - 0
139O4F17_HUMAN7 36% 0.221 PF00001 34 - (0)? - / - / - 0
140CCRL2_HUMAN19 38% 0.326 PF00001 44 - (0)? - / - / - 0
141P2Y12_HUMAN19 100% 0.290 PF00001 67 - (0)? - / - / - 0
142O10H5_HUMAN8 37% 0.276 PF00001 39 - (0)? - / - / - 0
143OR2G2_HUMAN11 47% 0.247 PF00001 31 - (0)? - / - / - 0
144OR1S2_HUMAN9 46% 0.226 PF00001 41 - (0)? - / - / - 0
145LSHR_HUMAN6 22% 0.297 PF10413 23 - (0)? - / - / - 0
146GP135_HUMAN20 35% 0.287 PF10413 28 - (0)? - / - / - 0
147GP146_HUMAN10 45% 0.272 PF00001 32 - (0)? - / - / - 0
148OR5M9_HUMAN7 33% 0.290 PF00001 42 - (0)? - / - / - 0
149OPSX_HUMAN20 47% 0.301 PF10413 70 - (0)? - / - / - 0
150OR2M2_HUMAN7 50% 0.292 PF00001 38 - (0)? - / - / - 0

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