Supplementary Table 1 Protein Name, PDB ID, Source Organism, Heteroatom Information And

Supplementary Table 1 Protein name, PDB ID, source organism, heteroatom information and resolution details for selected proteins

S. No. / Protein Name / PDB ID / Source / Heteroatoms / Resolution (Å)
1.a / GLYCERIALDEHYDE 3-OHOSPHATE DEHYDROGENASE / 1NQO / BACILIUS STEAROTHEIR MOPHILUSI / NAD, GLYCERALDEHYDE3-
PHOSPHATE / 2.01
b / GLYCERALD EHYDE 3 PHOSPHATE DEHYDROGE NASE / 1SZJ / PALINURUS VERSICOLOR / NAD / 2
c / CRYSTAL STRUCTURE OF APO GLYCERALD EHYDE 3 PHOSPHATE DEHYDROGE NASE / 1CRW / PALINURUS VERSICOLOR / APO FORM / 2
2 a / FRUCTOSE-BISPHOSPHATE ALDOLASE / 1GYN / ESCHERICHIA COLI / APO FORM / 2
b / FRUCTOSE-BISPHOSPHATE ALDOLASE / 1ZEN / ESCHERICHIA COLI / Zn / 2.5
C / FRUCTOSE-BISPHOSPHATE ALDOLASE / 1B57 / ESCHERICHIA COLI / Zn, O-PHOSPHOGLYCOLOH YDROXAMATE / 2
3 a / ASPARTATE AMINOTRANSFERASE / 1 AAM / ESCHERICHIA COLI / PYRIDOXAL-5 PHOSPHATE / 2.8
b / ASPARTATE AMINOTRANSFERASE / 1lVR / GALLUS GALLUS / APO FORM / 2.4
C / ASPARTATE AMINOTRANSFERASE / 1CZE / ESCHERICHIA COLI / PYRIDOXAL-5 PHOSPHATE SUCCINIC ACID / 2.4
4 a / BETA-KETOACYL-ACP SYNTHASE 3 / 1 HNK / ESCHERICHIA COLI / APO FORM / 1.9
b / BETA-KETOACYL-ACP SYNTHASE 3 / 1EBL / ESCHERICHIA COLI / SELENOMETHIONION / 1.8
C / BETA-KETOACYL-ACP SYNTHASE 3 / 1 HND / ESCHERICHIA COLI / COENZYME A / 1.6
5 a / LACATATE DEHYDROGENASE / 6LDH / SQUALUS ACANTHIAS / APO FORM / 2
b / LACATATE DEHYDROGENASE / 1LLD / BIFIDOBACTER IUM LONGUM / NAD / 2
c / LACATATE DEHYDROGENASE / 1U5C / PLASMODIUM FALCIPARUM / NAD, DIHYDROXY-2- NAPHTHOIC ACID / 2.65
6 a / THYMIDYLATE SYNTHASE / 1 TIS / BACTERIOPHA GE / APO FORM / 3.1
b / THYMIDYLATE SYNTHASE / 2 BBQ / ESCHERICHIA COLI / 2’-DEOXYURIDINE5, MONOPHOSPHATE10- PARPARGYL-5-8 DIDEAZAFOLATE-4- GLUTAMIC ACID / 2.3
c / THYMIDYLATE SYNTHASE / 1 DNA / ESCHERICHIA COLI / 2’-DEOXYURIDINE5, MONOPHOSPHATE / 2.2
7 a / GLUCODE DEHYDROGENASE / 1CQ1 / ACINETOBACTER CALCOACETICUS / PYRROLOQUINOLINE QUINONE GLUCOSE / 1.9
b / GLUCODE DEHYDROGENASE / 1C9U / ACINETOBACTER CALCOACETICUS / PYRROLOQUINOLINE QUINONE / 2.2
c / GLUCODE DEHYDROGENASE / 1QBI / ACINETOBACTER CALCOACETICUS / APO FORM / 1.72
8 a / ALDEHYDE DEHYDROGENASE / 1EUH / STREPTOCOCCUS MUTANS / APO FORM / 1.82
b / ALDEHYDE DEHYDROGENASE / 2EUH / STREPTOCOCCUS MUTANS / NADP / 2.6
c / ALDEHYDE DEHYDROGENASE / 1QI1 / STREPTOCOCCUS MUTANS / NADP AND D- GLYCERALDEHYDE-3 PHOSPHATE / 3
9 a / ADENOSINE DEAMINASE / 1ADD / ESCHERICHIA COLI / Zn, ADINOSINE / 2.4
ADENOSINE DEAMINASE / 1VFL / BOS TAURUS / Zn / 1.8
ADENOSINE DEAMINASE / 2AMX / PLASMODIUM YOELII / APO FORM / 2.02
10 a / GLUTATHIONE REDUCTASE / 1GRA / HOMO SAPIENS / GLUTATHIONE NADPH / 2
b / GLUTATHIONE REDUCTASE / 1GRT / ESCHERICHIA COLI / APO FORM(PHYSIOLOGICALY PRESENT WITH FAD) / 2.3
c / GLUTATHIONE REDUCTASE / 1GET / ESCHERICHIA COLI / NADPH / 2
11 a / COPPER-CONTAINING AMINE OXIDASE / 1IU7 / AROTHROBACTEE GLOBIFORMIS / Cu, TPQ / 1.8
b / AMINE OXIDASE / 1WMP / AROTHROBACTEE GLOBIFORMIS / APO FORM / 2
c / COPPER-CONTAINING AMINE OXIDASE / 1W5Z / ESCHERICHIA COLI / Cu, TPQ, BENZYLHYDRAZINE / 1.86
12 a / BILIVERDIN REDUCTASE / 1GCU / RATTUS NORVEGICUS / APO FORM / 1.4
b / BILIVERDIN REDUCTASE / 1HE2 / HOMOSAPIENS / NADP, BILIVERDINEIXALPHA / 1.2
c / BILIVERDIN REDUCTASE / 1LC3 / RATTUS NORVEGICUS / NADP, / 1.5
13 / 1NU / EMERICELLA / APO FORM / 2.85
a / 3-DEHYDROQUINATE SYNTHASE / A / NIDULANS
b / 3-DEHYDROQUINATE SYNTHASE / 1NRX / EMERICELLA NIDULANS / NAD / 2.9
C / 3-DEHYDROQUINATE SYNTHASE / 1NVB / EMERICELLA NIDULANS / NAD CARBAPHOSPHONATE / 2.7
14 a / MALIC ENZYME / 2AW5 / HOMO SAPIENS / APO FORM / 2.5
b / MALIC ENZYME / 1LLQ / ASCARIS SUUM / NAD / 2.3
c / MALIC ENZYME / 1EFK / HOMO SAPIENS / NAD ALPHA-KETOMALONIC ACIO / 2.6
15 a / MYROSINASE / 1.00E+72 / SINAPIS ALBA / Cofactor, GLUCO HYDROXIMOLACTAM / 1.6
b / MYROSINASE / 1.00E+71 / SINAPIS ALBA / ASCROBIC ACID (COFACTOR) / 1.5
c / MYROSINASE / 1MYR / SINAPIS ALBA / APO FORM / 1.64