PROCARB: A Database of Known and Modelled Carbohydrate-Binding Protein Structures with Sequence-Based Prediction Tools

Table 2

Various types of energies for each O-linked model after energy minimization.

S. No.	Uniprot Id (Model)	Initial Potential Energy (kcal/mol)	Potential Energy (kcal/mol)	Van der Waals Energy (kcal/mol)	Electrostatic Energy (kcal/mol)
(1)	P00304	1011.16	−3277.8	−107.88	−5373.8
(2)	P01217	−1564.4	−3973.3	−492.97	−4077.3
(3)	P01588	937.248	−8253.1	−991.77	−8539.6
(4)	P01866	4.1𝐸+10	−15390	−2062.7	−16107
(5)	P05451	−1936.7	−7479.7	−966.71	−7567.7
(6)	P06027	3794.54	−7010.8	−823.42	−7490.5
(7)	P06870	27038.2	−13000	−1715	−13041
(8)	P08514	140740.16	−49738.11	−4626.67	−57424.53
(9)	P26631	4.1𝐸+10	−2829.4	−263.85	−3032.5
(10)	P28314	−1098	−17977	−2188.1	−18289
(11)	P28512	165706808.06	−3414.87	−282.99	−3687.12
(12)	P36912	7304.93	−11640.89	−1207.84	−12525.97
(13)	P40225	−2638.4	−6971.1	−954.33	−7128.9
(14)	P48304	−2795	−7659	−930.64	−7811.2
(15)	P51671	76.0533	−2922.7	−436.77	−3114
(16)	P80370	−230.89	−1203.16	−102.38	−1272.45
(17)	P81054	127345.09	−19664.21	−1900.14	−21238.18
(18)	P81428	127345	−17179	−1873	−18763
(19)	P98119	3162.77	−18009.99	−1034.49	−23939.79
(20)	Q09163	15646.54	−5165.18	−500.29	−5614.36