Top chemical compounds for concept: c_0531
# Observed top chemical compounds associated with the concept c_0531
# mined from the 'HETATM' record lines within the wwPDB
# coordinate files of this concept's usages.
# -------------------------------------------------------------c_0531
# %Freq Ligand/Chemical Compound
# -------------------------------------------------------------------
33.3 130 SO4 SULFATE ION
17.4 68 KCX LYSINE NZ-CARBOXYLIC ACID
14.4 56 MG MAGNESIUM ION
9.2 36 PO4 PHOSPHATE ION
9.2 36 CL CHLORIDE ION
8.7 34 GOL GLYCEROL
7.9 31 EDO 1,2-ETHANEDIOL
6.9 27 CO COBALT (II) ION
4.1 16 NA SODIUM ION
3.8 15 NXL (2S,5R)-1-FORMYL-5-[(SULFOOXY)AMINO]PIPERIDINE-2-CARBOXAMIDE
3.3 13 MES 2-(N-MORPHOLINO)-ETHANESULFONIC ACID
2.8 11 IM2 (5R)-5-[(1S,2R)-1-FORMYL-2-HYDROXYPROPYL]-3-[(2-{[(E)-IMINOMETHYL]AMINO}ETHYL)SULFANYL]-4,5-DIHYDRO-1H-PYRROLE-2-CARBOXYLIC ACID
2.6 10 PNM OPEN FORM - PENICILLIN G
2.6 10 CIT CITRIC ACID
2.6 10 ACT ACETATE ION
2.3 9 SUC SUCROSE
2.3 9 SCN THIOCYANATE ION
2.3 9 MER (4R,5S)-3-{[(3S,5S)-5-(DIMETHYLCARBAMOYL)PYRROLIDIN-3-YL]SULFANYL}-5-[(2S,3R)-3-HYDROXY-1-OXOBUTAN-2-YL]-4-METHYL-4,5-DIHYDRO-1H-PYRROLE-2-CARBOXYLIC ACID
2.1 8 FP5 PHENYLACETAMIDOMETHYL BORONIC ACID
2.1 8 FMT FORMIC ACID
2.1 8 CD CADMIUM ION
2.1 8 ACN ACETONE
2.1 8 4J6 (4R,5S)-5-[(2S,3R)-3-HYDROXY-1-OXOBUTAN-2-YL]-4-METHYL-3-({(3S,5S)-5-[(SULFAMOYLAMINO)METHYL]PYRROLIDIN-3-YL}SULFANYL)-4,5-DIHYDRO-1H-PYRROLE-2-CARBOXYLIC ACID
1.8 7 PCZ (2R)-2-[(1R)-1-{[(2Z)-2-(2-AMINO-1,3-THIAZOL-4-YL)-2-(METHOXYIMINO)ACETYL]AMINO}-2-OXOETHYL]-5-METHYLIDENE-5,6-DIHYDRO-2H-1,3-THIAZINE-4-CARBOXYLIC ACID
1.8 7 CA CALCIUM ION
1.5 6 REZ (2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-7-OXOHEPTANOIC ACID
1.5 6 IOD IODIDE ION
1.5 6 EPE 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID
1.3 5 DAL D-ALANINE
1.3 5 CO2 CARBON DIOXIDE
1.3 5 BIY (3S)-2,2-DIMETHYL-3,4-DIHYDRO-2H-1,4-THIAZINE-3,6-DICARBOXYLIC ACID
1.0 4 ZA3 TRIHYDROXY-[[(2-NITROPHENYL)CARBONYLAMINO]METHYL]BORON
1.0 4 TFR (2R)-2-AMINO-7-OXO-7-{[(2R,3S)-4,4,4-TRIFLUORO-3-HYDROXYBUTAN-2-YL]AMINO}HEPTANOIC ACID
1.0 4 SFR (2R)-2-[(1S,2R)-1-CARBOXY-2-HYDROXYPROPYL]-5-[(2R)-TETRAHYDROFURAN-2-YL]-2,3-DIHYDRO-1,3-THIAZOLE-4-CARBOXYLIC ACID
1.0 4 REC CEPHALOSPORIN
1.0 4 POP PYROPHOSPHATE 2-
1.0 4 PGE TRIETHYLENE GLYCOL
1.0 4 NCF (2R)-2-{(1R)-2-OXO-1-[(2-THIENYLACETYL)AMINO]ETHYL}-5,6-DIHYDRO-2H-1,3-THIAZINE-4-CARBOXYLIC ACID
1.0 4 HQZ TRIHYDROXY{(1S)-1-[(METHYLSULFONYL)AMINO]ETHYL}BORATE(1-)
1.0 4 FPM (5R,6S)-6-(1-HYDROXYETHYL)-7-OXO-3-[(2R)-OXOLAN-2-YL]-4-THIA-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID
1.0 4 EWB [(1S)-1-{[(2-BENZYLPHENYL)CARBONYL]AMINO}ETHYL](TRIHYDROXY)BORATE(1-)
1.0 4 EWA [(1S)-1-{[(2,6-DIMETHOXYPHENYL)CARBONYL]AMINO}ETHYL]BORONIC ACID
1.0 4 CAZ ACYLATED CEFTAZIDIME
1.0 4 CAC CACODYLATE ION
1.0 4 BSF {[(BENZYLSULFONYL)AMINO]METHYL}BORONIC ACID
1.0 4 BO8 (D-ALPHA-AMINOPIMELYLAMINO)-D-1-ETHYLBORONIC ACID
1.0 4 BH6 {[(2-CHLOROBENZOYL)AMINO]METHYL}BORONIC ACID
1.0 4 BB0 1-[6-(DIMETHYLAMINO)NAPHTHALEN-2-YL]ETHANONE
1.0 4 B07 2,6 DIMETHOXYBENZAMIDOBORONIC ACID
1.0 4 AXL 2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID
1.0 4 ALP 2-(1-CARBOXY-2-HYDROXY-ETHYL)-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID
1.0 4 AIX (2R,4S)-2-[(1R)-1-{[(2R)-2-AMINO-2-PHENYLACETYL]AMINO}-2-OXOETHYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID
1.0 4 ACY ACETIC ACID
1.0 4 5F8 3-(pyridin-3-yl)benzoic acid
1.0 4 5F5 3-(1,3-thiazol-2-yl)benzoic acid
1.0 4 5F3 3,5-di(pyridin-4-yl)benzoic acid
1.0 4 33D 3,3-DIMETHYLBUTAN-1-OL
# -------------------------------------------------------------------
# Notes: %Freq gives (as a percentage) the number of usages
# of the concept in which the associated Chemical Compund or
# Ligand was observed in the HETATM record.
# -------------------------------------------------------------c_0531