Ligand Statistics

Code Name Deposits Targets Ligand Type
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on 481 350 other
MSE 301 244 modified residue
CL 220 185 crystallization
GOL 153 126 crystallization
SO4 153 119 crystallization
EDO ETHYLENE GLYCOL 106 90 crystallization
PEG polyethylene glycol 103 82 crystallization
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on 103 81 biological
NA Sodium ion 54 45 crystallization
CL 54 47 other
PGE TRIETHYLENE GLYCOL 50 48 crystallization
GOL 50 44 other
SO4 48 43 other
PO4 46 40 crystallization
FMT 44 39 crystallization
MG MAGNESIUM ION 43 40 crystallization
ACT 42 36 crystallization
ZN 39 30 biological
CA calcium ion 33 29 crystallization
IMP 30 7 biological
MG MAGNESIUM ION 30 27 other
TRS TRIS BUFFER 28 24 crystallization
NAD 26 16 biological
FAD 26 23 biological
K unknown 25 9 biological
MG MAGNESIUM ION 22 19 biological
NA Sodium ion 22 22 other
PG4 21 21 crystallization
PEG polyethylene glycol 21 19 other
EDO ETHYLENE GLYCOL 20 18 other
K unknown 18 17 crystallization
ACY 18 14 crystallization
CA calcium ion 18 17 other
PO4 15 14 other
FMT 15 12 other
ACT 15 15 other
BME 14 12 crystallization
EPE 14 11 crystallization
MPD unknown 13 10 crystallization
ACY 13 13 other
ZN 12 12 other
MLI 12 6 crystallization
BTB 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol 11 8 crystallization
PO4 11 10 biological
AMP 11 11 biological
PE3 11 8 crystallization
FMT 11 10 biological
MN unknown 11 9 biological
NI 10 8 crystallization
CIT 10 10 crystallization
ACO 10 7 biological
IPA 9 7 crystallization
SO4 8 8 biological
1PE 8 8 crystallization
ADP 8 8 biological
COA coenzyme A 8 7 biological
KAN 8 3 biological
P6G hexaethylene glycol 8 5 crystallization
ZN 8 8 crystallization
MES 7 6 crystallization
EPE 7 6 other
NA Sodium ion 7 2 biological
MES 6 6 other
NAP 6 6 biological
EOH ethanol 5 4 crystallization
CME 5 5 modified residue
SIN succinic acid 5 5 crystallization
IOD 5 5 crystallization
IMD 5 5 crystallization
GLC 5 2 biological
GDP 5 5 biological
FMN 5 5 biological
PG5 5 4 crystallization
TAR 5 5 crystallization
CA calcium ion 5 4 biological
SUC 5 5 crystallization
LLP 5 3 modified residue
NDP Nicotinamide adenine dinucleotide phosphate 4 4 biological
POP pyrophosphate 2- 4 4 biological
ANP phosphoaminophosphonic acid-adenylate ester 4 3 biological
SIA o-sialic acid 4 3 biological
AMP 4 4 other
IMD 4 4 other
MLT 4 4 crystallization
ACO 4 2 other
PLP pyridoxal-5'-phosphate 4 2 biological
UNX UNKNOWN ATOM 4 2 other
GAL beta-d-galactose 4 3 biological
NI 4 3 other
0V5 4 3 biological
ADP 3 3 other
ATP adenosine-5'-triphosphate 3 2 biological
B3P 2-[3-(2-hydroxy-1,1-dihydroxymethyl-ethylamino)-propyla mino]-2-hydroxymethyl-propane-1,3-diol 3 3 crystallization
BCT bicarbonate ion 3 3 crystallization
BME 3 3 other
BR bromide ion 3 3 crystallization
BU1 3 2 crystallization
C91 unknown 3 3 biological
CAC cacodylate ion 3 3 other
CD 3 3 crystallization
CSO S-HYDROXYCYSTEINE 3 3 modified residue
CSX S-OXY CYSTEINE 3 3 modified residue
DA unknown 3 2 biological
DC unknown 3 2 biological
DG unknown 3 2 biological
DMS dimethyl sulfoxide 3 3 crystallization
DT unknown 3 2 biological
FUC alpha-l-fucose 3 3 biological
KCX 3 3 modified residue
MLT 3 3 biological
MPD unknown 3 3 other
P33 3,6,9,12,15,18-hexaoxaicosane-1,20-diol 3 3 crystallization
PGO 3 1 crystallization
POP pyrophosphate 2- 3 3 crystallization
Q21 unknown 3 3 biological
S3P shikimate-3-phosphate 3 2 biological
TAR 3 3 other
XMP 3 3 biological
P2H 2 2 biological
MRD (4R)-2-methylpentane-2,4-diol 2 2 crystallization
MAL maltose 2 2 biological
DSZ 5'-o-(l-alpha-aspartylsulfamoyl)adenosine 2 2 biological
P3G 3,6,9,12,15-pentaoxaheptadecane 2 2 other
MTX 2 2 biological
EPE 2 2 biological
CXS 3-cyclohexyl-1-propylsulfonic acid 2 2 crystallization
6JZ 3,6,9,12,15-pentaoxaheptadecane 2 2 other
SBT 2-butanol 2 2 crystallization
SCN thiocyanate ion 2 2 crystallization
5GP guanosine-5'-monophosphate 2 2 biological
2D8 2 2 crystallization
PCA pyroglutamic acid 2 1 modified residue
225 2 1 crystallization
LIG 3-pyridin-4-yl-2,4-dihydro-indeno[1,2-.c.]pyrazole 2 2 biological
BGC 2 2 biological
BDF beta-d-fructopyranose 2 2 crystallization
SIN succinic acid 2 2 other
SIS sisomicin 2 2 biological
SKM 2 2 biological
MLA 2 2 biological
MLA 2 2 crystallization
NAJ nicotinamide-adenine-dinucleotide (acidic form) 2 1 biological
LLL 2 2 biological
NAP 2 2 other
PG4 2 2 biological
GOA glycolic acid 2 2 crystallization
PG4 2 2 other
BDF beta-d-fructopyranose 2 2 biological
SUC 2 2 other
GOL 2 2 biological
UVW acetylphosphate 2 2 biological
ADN adenosine 2 2 biological
Z11 2 2 biological
176 2 2 biological
THM thymidine 2 2 biological
PGE TRIETHYLENE GLYCOL 2 2 other
EPU uridine-diphosphate-2(n-acetylglucosaminyl) butyric aci d 2 2 biological
PLM palmitic acid 2 1 crystallization
TOY tobramycin 2 2 biological
NHE 2-[n-cyclohexylamino]ethane sulfonic acid 2 1 crystallization
MLT 2 2 other
TPP thiamine diphosphate 2 1 other
ATP adenosine-5'-triphosphate 2 1 other
TRS TRIS BUFFER 2 2 other
TTN tartronate 2 2 crystallization
NI 2 2 biological
LMR (2s)-2-hydroxybutanedioic acid 2 1 other
15P 2 1 crystallization
UNK unknown 2 2 modified residue
UNL 2 1 biological
3DS (4s,5r)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid 2 1 biological
BGC 2 2 crystallization
DRG 2 2 crystallization
NO3 nitrate ion 2 2 crystallization
79V 2 1 crystallization
PRF 7-deaza-7-aminomethyl-guanine 2 1 biological
NXP n-{4-[(1e)-n-carbamimidoylethanehydrazonoyl]phenyl}-1h-indole-3-carboxamide 2 1 crystallization
MO6 magnesium ion, 6 waters coordinated 2 1 crystallization
MOA mycophenolic acid 2 1 biological
MOH methanol 2 1 crystallization
PXP pyroxidine-5'-phosphate 2 2 biological
CP carbamoyl phosphate 2 1 biological
GPJ glyphosate 2 2 biological
OXP 2-oxo-3-pentenoic acid 2 2 biological
CS 2 1 crystallization
AE3 2-(2-ethoxyethoxy)ethanol 2 2 other
CSO S-HYDROXYCYSTEINE 2 2 biological
CSO S-HYDROXYCYSTEINE 2 2 crystallization
AMP 2 2 crystallization
P18 2 2 biological
LY0 2 2 crystallization
P1T 2 1 biological
5WQ 1 1 biological
0TO 1 1 crystallization
KAN 1 1 crystallization
XPE 3,6,9,12,15,18,21,24,27-nonaoxanonacosane-1,29-diol 1 1 crystallization
KHL 1 1 biological
KP3 1 1 biological
LI lithium ion 1 1 crystallization
LI lithium ion 1 1 other
LLP 1 1 biological
CEA 1 1 modified residue
LMR (2s)-2-hydroxybutanedioic acid 1 1 biological
LMR (2s)-2-hydroxybutanedioic acid 1 1 crystallization
LMT dodecyl-beta-d-maltoside 1 1 crystallization
LN0 1 1 biological
LTR l-tryptophan 1 1 biological
MCL nz-(1-carboxyethyl)-lysine 1 1 biological
CAC cacodylate ion 1 1 crystallization
ACX alpha-cyclodextrin (cyclohexa-amylose) 1 1 other
5WP 1 1 biological
537 2,6-dihydroanthra/1,9-cd/pyrazol-6-one 1 1 crystallization
MLA 1 1 other
MLC 1 1 crystallization
3GR glyceraldehyde 1 1 other
MLI 1 1 other
ADE adenine 1 1 biological
MLZ n-methyl-lysine 1 1 crystallization
MN unknown 1 1 crystallization
MN unknown 1 1 other
3D1 (2r,3s,5r)-5-(6-amino-9h-purin-9-yl)-tetrahydro-2-(hydr oxymethyl)furan-3-ol 1 1 biological
Z32 unknown 1 1 biological
30N (3r,5s,9r)-1-[(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-tr ihydroxy-8,8-dimethyl-10,14-dioxo-2,4,6-trioxa-11,15-di aza-3,5-diphosphaheptadecane-17-sulfinic acid 3,5-dioxi de (non-preferred name) 1 1 biological
MSO selenomethionine selenoxide 1 1 modified residue
MTX 1 1 crystallization
MWL 1 1 crystallization
N09 unknown 1 1 biological
BU1 1 1 other
225 1 1 biological
NAE nicotinamide adenine dinucleotide acetone adduct 1 1 other
NAG n-acetyl-d-glucosamine 1 1 biological
BTB 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol 1 1 other
NAX beta-6-hydroxy-1,4,5,6-tetrhydronicotinamide adenine di nucleotide 1 1 biological
NBO 1 1 biological
NDB Dimethyl(2 hydroxyethyl)ammonium propane sulfonate 1 1 crystallization
NEP n1-phosphonohistidine 1 1 modified residue
NEU l-neopterin 1 1 biological
Ni unknown 1 1 biological
221 1 1 crystallization
bpa unknown 1 1 crystallization
NO2 nitrite ion 1 1 crystallization
NVA norvaline 1 1 crystallization
OAA oxaloacetate ion 1 1 biological
OCA octanoic acid (caprylic acid) 1 1 biological
OCS cysteinesulfonic acid 1 1 other
OPE 1 1 biological
P18 1 1 crystallization
P2H 1 1 crystallization
ZD2 (2s)-4-(6-amino-9h-purin-9-yl)-2-hydroxybutanoic acid 1 1 biological
P3G 3,6,9,12,15-pentaoxaheptadecane 1 1 crystallization
P41 1 1 biological
P5G PEG 1 1 crystallization
P68 unknown 1 1 biological
0JN 1-tert-butyl-3-(naphthalen-1-ylmethyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amine 1 1 crystallization
PAF pantoate 1 1 biological
PCA pyroglutamic acid 1 1 crystallization
221 1 1 biological
PE5 3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol 1 1 crystallization
PE8 3,6,9,12,15,18,21-heptaoxatricosane-1,23-diol 1 1 crystallization
PEG polyethylene glycol 1 1 biological
178 1 1 crystallization
178 1 1 biological
PEP phosphoenolpyruvate 1 1 biological
176 1 1 crystallization
BO3 1 1 crystallization
PG5 1 1 other
PG6 1-(2-methoxy-ethoxy)-2-{2-[2-(2-methoxy-ethoxy]-ethoxy}-ethane 1 1 other
PGE TRIETHYLENE GLYCOL 1 1 biological
ZIT 1 1 biological
ADP 1 1 crystallization
PLP pyridoxal-5'-phosphate 1 1 other
PO3 phosphite ion 1 1 crystallization
16G n-acetyl-d-glucosamine-6-phosphate 1 1 biological
13P 1,3-dihydroxyacetonephosphate 1 1 other
ZIT 1 1 crystallization
PP1 1-ter-butyl-3-p-tolyl-1h-pyrazolo[3,4-d]pyrimidin-4-yla mine 1 1 crystallization
PP2 1-tert-butyl-3-(4-chloro-phenyl)-1h-pyrazolo[3,4-d]pyri midin-4-ylamine 1 1 crystallization
PRP 1 1 biological
PTA [(1-amino-3-methyl-butyl)-hydroxy-phosphinoyl]-acetic a cid 1 1 crystallization
PTW 1,3,5-triaza-7-phosphatricyclo[3.3.1.1~3,7~]decane 1 1 biological
PXG 3-[o-phosphonopyridoxyl]--amino-benzoic acid 1 1 biological
PYR pyruvic acid 1 1 biological
PYR pyruvic acid 1 1 other
Q67 1 1 biological
QIC (1s,3r,4s,5r)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid 1 1 biological
QUE 3,5,7,3',4'-pentahydroxyflavone 1 1 crystallization
R5P ribose-5-phosphate 1 1 biological
RBF riboflavine 1 1 crystallization
RFP 1 1 biological
RI2 1,5-di-o-phosphono-alpha-d-ribofuranose 1 1 biological
RP5 ribose-5-phosphate, pyranose form 1 1 biological
AKG 2-oxyglutaric acid 1 1 biological
SAH s-adenosyl-l-homocysteine 1 1 modified residue
SAM s-adenosylmethionine 1 1 biological
SAM s-adenosylmethionine 1 1 crystallization
SCY s-acetyl-cysteine 1 1 modified residue
SEE trihydroxy(l-serinato-kappao~3~)borate(1-) 1 1 modified residue
SEP phosphoserine 1 1 biological
SEP phosphoserine 1 1 other
SHL modified comenic acid 1 1 biological
SKM 1 1 other
0J9 1-tert-butyl-3-(naphthalen-1-yl)-1h-pyrazolo[3,4-d]pyri midin-4-amine 1 1 crystallization
13P 1,3-dihydroxyacetonephosphate 1 1 biological
131 1 1 biological
SOO s-[2-[3-[[(2s)-2-hydroxy-3,3-dimethyl-4-phosphonooxy-bu tanoyl]amino]propanoylamino]ethyl] (e)-oct-2-enethioate 1 1 other
SPM spermine 1 1 biological
SR1 1 1 biological
SR2 1 1 crystallization
AXP 4-acetamido-2,4-didexoy-d-glycero-beta-d-galacto-octopy ranosylphosphonic acid (an axial phosphonate) 1 1 biological
ALY 1 1 modified residue
TBK unknown 1 1 biological
TDP thiamin diphosphate 1 1 biological
TES testosterone 1 1 biological
TMN 1 1 biological
TMN 1 1 crystallization
TMP thymidine-5'-phosphate 1 1 biological
TPO phosphothreonine 1 1 modified residue
TPP thiamine diphosphate 1 1 biological
TYD thymidine-5'-diphosphate 1 1 biological
U5P uridine-5'-monophosphate 1 1 biological
UD1 uridine-diphosphate-n-acetylglucosamine 1 1 biological
UNL 1 1 crystallization
UNM 7-[(cis-4-aminocyclohexyl)amino]-5-bromo-1-benzofuran-2-carboxylic acid 1 1 biological
UNX UNKNOWN ATOM 1 1 biological
UNX UNKNOWN ATOM 1 1 crystallization
CMP adenosine-3',5'-cyclic-monophosphate 1 1 biological
CO3 carbonate ion 1 1 crystallization
CO8 octanoyl-coenzyme a 1 1 biological
Zn 1 1 biological
COA coenzyme A 1 1 crystallization
COA coenzyme A 1 1 other
COD dephospho coenzyme a 1 1 other
CPS 3-[(3-cholamidopropyl)dimethylammonio]-1-propanesulfona te 1 1 crystallization
CRY propane-1,2,3-triol 1 1 other
CSA 1 1 modified residue
URA uracil 1 1 other
CTO triacetylchitotriose 1 1 biological
CTS castanospermine 1 1 biological
CTP cytidine-5'-phosphate 1 1 other
CU 1 1 biological
CYT 6-aminopyrimidin-2(1h)-one 1 1 other
D67 1 1 biological
URE urea 1 1 crystallization
DAL 1 1 biological
DAL 1 1 crystallization
DAU 2'deoxy-thymidine-5'-diphospho-alpha-d-glucose 1 1 biological
URI uridine 1 1 biological
DCF 2'-deoxycoformycin 1 1 crystallization
DEA d-eritadenine 1 1 biological
DGL d-glutamic acid 1 1 biological
DKA 1 1 biological
DME decamethonium ion 1 1 crystallization
VCA 1 1 biological
AM2 1 1 biological
DTT 2,3-dihydroxy-1,4-dithiobutane 1 1 crystallization
EDO ETHYLENE GLYCOL 1 1 biological
A5A '5'-o-(n-(l-alanyl)-sulfamoyl)adenosine 1 1 biological
9MG 9-methylguanine 1 1 crystallization
EDS 1 1 biological
EMM [methyl(vinyl)amino]methanol 1 1 crystallization
CME 1 1 crystallization
9DA 9-deazaadenine 1 1 biological
A5P arabinose-5-phosphate 1 1 biological
ETD ethenylene group 1 1 biological
ETS (4s-trans)-4-(ethylamino)-5,6-dihydro-6-methyl-4h-thien o(2,3-b)thiopyran-2-sulfonamide-7,7-dioxide 1 1 biological
F unknown 1 1 crystallization
F6P fructose-6-phosphate 1 1 biological
F6P fructose-6-phosphate 1 1 other
F6R fructose -6-phosphate 1 1 biological
8MM 1 1 biological
FAD 1 1 other
FCN fosfomycin 1 1 biological
FCN fosfomycin 1 1 crystallization
FE 1 1 biological
FE 1 1 other
FFQ [(1r)-1-hydroxypropyl]phosphonic acid 1 1 biological
FLC citrate anion 1 1 biological
FLC citrate anion 1 1 crystallization
FLC citrate anion 1 1 other
CL 1 1 modified residue
7PE 2-(2-(2-(2-(2-(2-ethoxyethoxy)ethoxy)ethoxy)ethoxy)etho xy)ethanol 1 1 crystallization
7CY (1r,2s,3r,5r)-3-(6-amino-9h-purin-9-yl)-5-(hydroxymethy l)cyclopentane-1,2-diol 1 1 biological
XMX 1 1 crystallization
FUM fumaric acid 1 1 crystallization
G36 o6-ethyl-2'-deoxyguanosine-5'-monophosphate 1 1 biological
G6Q glucose-6-phosphate 1 1 biological
CL 1 1 biological
CIT 1 1 other
GDP 1 1 other
GG5 4-[3-(4-fluorophenyl)-1h-pyrazol-4-yl]pyridine 1 1 crystallization
ACT 1 1 modified residue
GLT 1 1 biological
6PG 6-phosphogluconic acid 1 1 biological
6PC 1 1 biological
GP1 glucosamine 1-phosphate 1 1 biological
GPE l-alpha-glycerophosphorylethanolamine 1 1 biological
GTT glutathione 1 1 biological
GUN guanine 1 1 biological
GUN guanine 1 1 crystallization
H01 protoporphyrin ix 2,4-disulfonic acid 1 1 biological
H01 protoporphyrin ix 2,4-disulfonic acid 1 1 other
HEZ hexane-1,6-diol 1 1 crystallization
HGA glutamine hydroxamate 1 1 biological
I22 d-altro-hept-2-ulose 7-phosphate 1 1 biological
IHP inositol hexakisphosphate 1 1 biological
CIT 1 1 biological
CIR citrulline 1 1 biological
6L0 1 1 biological
CEX alpha-d-glucopyranosyl-(1->4)-alpha-d-glucopyranosyl-(1->4)-alpha-d-glucopyranosyl-(1->4)-alpha-d-glucopyranos yl-(1->4)-alpha-d-glucopyranose 1 1 biological
IPA 1 1 other
IYR 3-iodo-tyrosine 1 1 modified residue
649 5'-o-[(11-phenoxyundecanoyl)sulfamoyl]adenosine 1 1 biological