In order to avoid security-related warning messages when switching to secured connection, you may want either to:

Click here to proceed.

Full alphabetical table:


ID
(D-form)
Full name 2D structure Structure Files PDB link Rotamer files Topology files
2AG 2-Allyl-glycine 2AG.pdb
2AG.mol2
2AG.smi

Dock me
PDB
Ligand
2AG_bbdep
2AG_bbind
2AG.top
2AG.rtp
2AG.hdb
ABA 2-Aminobutyric acid ABA.pdb
ABA.mol2
ABA.smi

Dock me
PDB
Ligand
ABA_bbdep
ABA_bbind
ABA.top
ABA.rtp
ABA.hdb
ACZ cis-amiclenomycin ACZ.pdb
ACZ.mol2
ACZ.smi

Dock me
PDB
Ligand
ACZ_bbdep
ACZ_bbind
ACZ.top
ACZ.rtp
ACZ.hdb
ADAM Adamanthane ADAM.pdb
ADAM.mol2
ADAM.smi

Dock me
PDB
Ligand
ADAM_bbdep
ADAM_bbind
ADAM.top
ADAM.rtp
ADAM.hdb
AHP 2-Aminoheptanoic acid AHP.pdb
AHP.mol2
AHP.smi

Dock me
PDB
Ligand
AHP_bbdep
AHP_bbind
AHP.top
AHP.rtp
AHP.hdb
ALA Alanine ALA.pdb
ALA.mol2
ALA.smi

Dock me
PDB
Ligand
ALC 3-cyclohexyl-alanine ALC.pdb
ALC.mol2
ALC.smi

Dock me
PDB
Ligand
ALC_bbdep
ALC_bbind
ALC.top
ALC.rtp
ALC.hdb
BIU 5-bromo-l-isoleucine BIU.pdb
BIU.mol2
BIU.smi

Dock me
PDB
Ligand
BIU_bbdep
BIU_bbind
BIU.top
BIU.rtp
BIU.hdb
BUG Tertleucine BUG.pdb
BUG.mol2
BUG.smi

Dock me
PDB
Ligand
BUG_bbdep
BUG_bbind
BUG.top
BUG.rtp
BUG.hdb
C2N 3-chloro-l-alanine C2N.pdb
C2N.mol2
C2N.smi

Dock me
PDB
Ligand
C2N_bbdep
C2N_bbind
C2N.top
C2N.rtp
C2N.hdb
CHG Cyclohexylglycine CHG.pdb
CHG.mol2
CHG.smi

Dock me
PDB
Ligand
CHG_bbdep
CHG_bbind
CHG.top
CHG.rtp
CHG.hdb
CPA3 3-Cyclopentyl-alanine CPA3.pdb
CPA3.mol2
CPA3.smi

Dock me
PDB
Ligand
CPA3_bbdep
CPA3_bbind
CPA3.top
CPA3.rtp
CPA3.hdb
DILE Diethylalanine DILE.pdb
DILE.mol2
DILE.smi

Dock me
PDB
Ligand
DILE_bbdep
DILE_bbind
DILE.top
DILE.rtp
DILE.hdb
FLA Trifluoro-alanine FLA.pdb
FLA.mol2
FLA.smi

Dock me
PDB
Ligand
FLA_bbdep
FLA_bbind
FLA.top
FLA.rtp
FLA.hdb
FVAL 3-Fluoro-valine FVAL.pdb
FVAL.mol2
FVAL.smi

Dock me
PDB
Ligand
FVAL_bbdep
FVAL_bbind
FVAL.top
FVAL.rtp
FVAL.hdb
HLEU Homoleucine HLEU.pdb
HLEU.mol2
HLEU.smi

Dock me
PDB
Ligand
HLEU_bbdep
HLEU_bbind
HLEU.top
HLEU.rtp
HLEU.hdb
I2M 3-methyl-l-alloisoleucine I2M.pdb
I2M.mol2
I2M.smi

Dock me
PDB
Ligand
I2M_bbdep
I2M_bbind
I2M.top
I2M.rtp
I2M.hdb
IGL alpha-amino-2-indanacetic acid IGL.pdb
IGL.mol2
IGL.smi

Dock me
PDB
Ligand
IGL_bbdep
IGL_bbind
IGL.top
IGL.rtp
IGL.hdb
IIL Allo-Isoleucine IIL.pdb
IIL.mol2
IIL.smi

Dock me
PDB
Ligand
IIL_bbdep
IIL_bbind
IIL.top
IIL.rtp
IIL.hdb
ILE Isoleucine ILE.pdb
ILE.mol2
ILE.smi

Dock me
PDB
Ligand
ILE_bbdep
ILE_bbind
LEF (4s)-5-fluoro-l-leucine LEF.pdb
LEF.mol2
LEF.smi

Dock me
PDB
Ligand
LEF_bbdep
LEF_bbind
LEF.top
LEF.rtp
LEF.hdb
LEU Leucine LEU.pdb
LEU.mol2
LEU.smi

Dock me
PDB
Ligand
LEU_bbdep
LEU_bbind
LVG vinylglycine LVG.pdb
LVG.mol2
LVG.smi

Dock me
PDB
Ligand
LVG_bbdep
LVG_bbind
LVG.top
LVG.rtp
LVG.hdb
NLE Norleucine NLE.pdb
NLE.mol2
NLE.smi

Dock me
PDB
Ligand
NLE_bbdep
NLE_bbind
NLE.top
NLE.rtp
NLE.hdb
NVA Norvaline NVA.pdb
NVA.mol2
NVA.smi

Dock me
PDB
Ligand
NVA_bbdep
NVA_bbind
NVA.top
NVA.rtp
NVA.hdb
OBF (2s)-2-amino-4,4-difluorobutanoic acid OBF.pdb
OBF.mol2
OBF.smi

Dock me
PDB
Ligand
OBF_bbdep
OBF_bbind
OBF.top
OBF.rtp
OBF.hdb
TFLE 5,5,5-Trifluoro-leucine TFLE.pdb
TFLE.mol2
TFLE.smi

Dock me
PDB
Ligand
TFLE_bbdep
TFLE_bbind
TFLE.top
TFLE.rtp
TFLE.hdb
VAL Valine VAL.pdb
VAL.mol2
VAL.smi

Dock me
PDB
Ligand
VAL_bbdep
VAL_bbind
i