3TTO

crystal structure of leuconostoc mesenteroides nrrl b-1299 n- terminally truncated dextransucrase dsr-e in triclinic form

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 55
  • Norm. En. per Res.: -1.9691
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-5.9819	18.22	-108.668	-96.4299	99	6	0	5185	1	24	21
A-C	-5.2552	2.1661	-70.1862	-73.2753	63	2	1	3164	2	24	22
A-D	-2.8432	-1.7431	-74.6507	-79.237	61	6	2	3251	1	17	12
B-C	-4.4305	-15.454	-88.4144	-108.2989	55	7	0	3307	1	20	23
C-D	0.0	9.6241	-17.1439	-7.5198	29	0	0	774	0	7	8

Interface residues

• A-B: ALA1947B, ALA2456A, ALA2495A, ALA2512A, ALA2558A, ARG1922B, ARG2458A, ARG2494A, ASN1946B, ASN1978B, ASN1985B, ASN2490A, ASN2508A, ASN2531A, ASN2535A, ASN2561A, ASN2615A, ASN2621A, ASN2819B, ASP1918B, ASP1945B, ASP1960B, ASP1981B, ASP2510A, ASP2534A, ASP2560A, ASP2617A, ASP2816B, ASP2826B, ASP2828B, GLN1917B, GLN1929B, GLN1956B, GLN2491A, GLN2511A, GLN2528A, GLN2533A, GLN2537A, GLN2562A, GLN2821B, GLN2834B, GLU2529A, GLY1799B, GLY1949B, GLY1961B, GLY2532A, GLY2557A, GLY2820B, GLY2827B, HIS2818B, ILE1800B, ILE1958B, ILE2530A, LEU1930B, LEU1980B, LEU2148B, LEU2498A, LEU2832B, LYS1932B, LYS2405A, LYS2492A, LYS2614A, LYS2815B, LYS2824B, LYS2829B, MET1982B, PHE2507A, PHE2823B, PRO2147B, PRO2513A, PRO2833B, SER1983B, SER2455A, SER2509A, SER2559A, SER2830B, THR1797B, THR1798B, THR1948B, THR1963B, THR1979B, THR1984B, THR1989B, THR2417A, THR2459A, THR2514A, THR2536A, THR2831B, TRP2516A, TRP2622A, TRP2817B, TYR1943B, TYR2409A, TYR2822B, VAL1957B, VAL1959B, VAL2413A, VAL2556A, VAL2618A
• A-C: ALA2065C, ALA2601A, ARG1852C, ASN1855C, ASN1856C, ASN2343A, ASN2661A, ASP1822C, ASP1873C, ASP1888C, ASP1889C, ASP2099A, ASP2346A, ASP2605A, ASP2638A, ASP2647A, ASP2671A, GLN1811C, GLN1841C, GLN1843C, GLN2348A, GLN2400A, GLN2734A, GLU2347A, GLU2606A, GLY1842C, GLY1861C, GLY1877C, GLY2637A, GLY2667A, HIS2096A, HIS2604A, HIS2639A, ILE1837C, ILE1858C, LEU1839C, LEU1862C, LEU2607A, LYS1840C, LYS1846C, LYS1860C, LYS2600A, LYS2665A, PHE1871C, PHE2344A, PRO1874C, PRO2663A, THR1836C, THR1838C, THR1857C, THR1876C, THR2063C, THR2345A, THR2602A, THR2603A, THR2645A, THR2662A, THR2664A, THR2668A, TYR1875C, TYR1887C, TYR2666A, VAL2610A
• A-D: ALA2058A, ALA2065A, ALA2066A, ALA2087A, ALA2093A, ALA2197D, ALA2202D, ALA2674D, ARG1784A, ARG2090A, ARG2673D, ASN2023A, ASN2661D, ASP2605D, ASP2669D, ASP2671D, GLN1811A, GLN2067A, GLN2199D, GLN2677D, GLN2734D, GLN2742D, GLU1812A, GLY1810A, GLY2024A, GLY2060A, GLY2198D, GLY2670D, HIS2604D, ILE1809A, ILE2195D, LEU1783A, LEU1825A, LEU2062A, LEU2607D, LEU2672D, LYS2057A, LYS2738D, LYS2793D, MET1828A, PHE2192D, PHE2660D, PRO1827A, THR1813A, THR1830A, THR2025A, THR2026A, THR2063A, THR2064A, THR2194D, THR2196D, THR2602D, THR2603D, THR2668D, THR2675D, TYR1814A, TYR2188D, TYR2735D, TYR2739D, VAL2086A, VAL2610D
• B-C: ALA2311B, ALA2449C, ASN2309B, ASN2433C, ASN2450B, ASN2450C, ASN2475C, ASN2527C, ASN2573B, ASN2582B, ASP2432C, ASP2445B, ASP2451B, ASP2476C, ASP2478C, ASP2483C, ASP2575B, GLN2235B, GLN2304C, GLN2310B, GLN2473C, GLN2520C, GLN2528C, GLU2237B, GLU2308B, GLU2572B, GLY2435C, GLY2453B, GLY2576B, HIS2434C, HIS2574B, HIS2580B, LEU2452B, LEU2472C, LEU2474C, LYS2383B, LYS2438C, LYS2471C, LYS2479C, LYS2489B, LYS2577B, MET2447B, SER2236B, SER2306B, SER2430C, SER2477C, SER2581B, THR2307B, THR2448B, THR2448C, THR2454B, THR2569B, THR2570B, THR2571B, VAL2431C
• C-D: ALA2512D, ALA2558D, ARG2036C, ASN2110C, ASN2508D, ASN2561D, ASN2621D, ASP2099C, ASP2510D, ASP2560D, GLN2102C, GLN2109C, GLN2511D, GLU2095C, GLU2107C, GLY2097C, HIS2096C, LEU2104C, LYS2033C, LYS2103C, MET2035C, PHE2507D, SER2108C, SER2509D, SER2559D, THR2098C, THR2506D, TRP2014C, TRP2100C