| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
T |
138 |
43 |
11184 |
◊ |
L |
x,y,z |
1_555 |
130 |
35 |
10776 |
1284.9 |
-6.3 |
0.477 |
17 |
8 |
0 |
0.148 |
| 2 |
2 |
|
H |
103 |
28 |
11911 |
◊ |
L |
x,y,z |
1_555 |
108 |
24 |
10776 |
968.5 |
-7.5 |
0.434 |
19 |
5 |
1 |
0.161 |
| 3 |
3 |
|
T |
54 |
17 |
11184 |
◊ |
H |
x,y,z |
1_555 |
55 |
16 |
11911 |
561.5 |
0.4 |
0.643 |
13 |
4 |
0 |
0.037 |
| 4 |
4 |
|
H |
44 |
17 |
11911 |
◊ |
L |
x-1/2,-y+1/2,-z+1 |
4_456 |
34 |
10 |
10776 |
413.2 |
-6.1 |
0.127 |
3 |
0 |
0 |
0.000 |
| 5 |
5 |
|
H |
42 |
14 |
11911 |
◊ |
T |
-x+1/2,-y,z-1/2 |
2_554 |
41 |
14 |
11184 |
392.2 |
1.4 |
0.658 |
6 |
5 |
0 |
0.000 |
| 6 |
6 |
|
H |
27 |
11 |
11911 |
◊ |
T |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
13 |
11184 |
308.4 |
-2.8 |
0.305 |
2 |
2 |
0 |
0.000 |
| 7 |
7 |
|
H |
39 |
9 |
11911 |
◊ |
L |
-x+1,y-1/2,-z+1/2 |
3_645 |
36 |
12 |
10776 |
301.6 |
0.7 |
0.759 |
3 |
0 |
0 |
0.000 |
| 8 |
8 |
|
T |
28 |
11 |
11184 |
x |
T |
x-1/2,-y+1/2,-z+1 |
4_456 |
27 |
10 |
11184 |
264.9 |
-3.9 |
0.136 |
1 |
0 |
0 |
0.000 |
| 9 |
9 |
|
L |
31 |
10 |
10776 |
x |
L |
x-1/2,-y+1/2,-z+1 |
4_456 |
28 |
9 |
10776 |
261.4 |
-0.4 |
0.628 |
3 |
1 |
0 |
0.000 |
| 10 |
10 |
|
T |
29 |
7 |
11184 |
◊ |
L |
x-1/2,-y+1/2,-z+1 |
4_456 |
27 |
11 |
10776 |
258.3 |
-0.3 |
0.604 |
1 |
0 |
0 |
0.000 |
| 11 |
11 |
|
H |
35 |
11 |
11911 |
x |
H |
x-1/2,-y+1/2,-z |
4_455 |
25 |
9 |
11911 |
247.9 |
-1.0 |
0.557 |
3 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[BEN]H:1 |
9 |
1 |
279 |
f |
H |
x,y,z |
1_555 |
33 |
16 |
11911 |
181.7 |
5.2 |
0.462 |
4 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[BGC]L:143 |
10 |
1 |
294 |
cf |
L |
x,y,z |
1_555 |
15 |
5 |
10776 |
117.8 |
2.0 |
0.337 |
0 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[FUC]L:144 |
9 |
1 |
282 |
cf |
L |
x,y,z |
1_555 |
16 |
7 |
10776 |
116.2 |
3.2 |
0.520 |
0 |
0 |
0 |
0.000 |
| 15 |
15 |
|
L |
11 |
3 |
10776 |
◊ |
T |
x-1/2,-y+1/2,-z+1 |
4_456 |
8 |
3 |
11184 |
73.0 |
-1.1 |
0.399 |
0 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[CL]H:14 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
12 |
5 |
11911 |
68.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.085 |
| 17 |
17 |
|
[CL]T:211 |
1 |
1 |
125 |
f |
T |
x,y,z |
1_555 |
10 |
7 |
11184 |
66.8 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.122 |
| 18 |
18 |
|
[NA]H:10 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
5 |
4 |
11911 |
63.1 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.097 |
| 19 |
19 |
|
[FUC]L:144 |
3 |
1 |
282 |
◊ |
T |
x,y,z |
1_555 |
4 |
2 |
11184 |
55.1 |
1.4 |
0.550 |
1 |
0 |
0 |
0.000 |
| 20 |
20 |
|
[MG]L:151 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
2 |
2 |
10776 |
48.9 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.095 |
| 21 |
21 |
|
[CA]L:150 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
8 |
5 |
10776 |
46.7 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.208 |
22 |
|
[CA]L:149 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
4 |
4 |
10776 |
33.6 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.208 |
| Average: |
40.2 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.208 |
| 22 |
23 |
|
[CA]H:9 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
8 |
5 |
11911 |
43.5 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.097 |
| 23 |
24 |
|
[CA]L:152 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
5 |
4 |
10776 |
43.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.120 |
| 24 |
25 |
|
[CA]L:147 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
8 |
5 |
10776 |
42.9 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.096 |
| 25 |
26 |
|
[CA]L:146 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
4 |
2 |
10776 |
38.1 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.082 |
| 26 |
27 |
|
[MG]L:145 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
3 |
2 |
10776 |
37.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.068 |
| 27 |
28 |
|
L |
3 |
1 |
10776 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
11911 |
25.9 |
0.1 |
0.573 |
0 |
0 |
0 |
0.000 |
| 28 |
29 |
|
[CL]H:14 |
1 |
1 |
125 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
11911 |
16.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 29 |
30 |
|
[CA]L:147 |
1 |
1 |
85 |
f |
[CA]L:146 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.037 |
| 30 |
31 |
|
[CA]L:149 |
1 |
1 |
85 |
f |
[MG]L:148 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.2 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.029 |
| 31 |
32 |
|
L |
1 |
1 |
10776 |
◊ |
[MG]L:145 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
98 |
12.2 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 32 |
33 |
|
H |
2 |
1 |
11911 |
◊ |
[MG]L:145 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
98 |
10.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 33 |
34 |
|
[CA]L:150 |
1 |
1 |
85 |
f |
[CA]L:149 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.027 |
| 34 |
35 |
|
T |
2 |
1 |
11184 |
◊ |
[MG]L:145 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
98 |
8.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 35 |
36 |
|
[CA]L:147 |
1 |
1 |
85 |
f |
[MG]L:148 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.020 |
| 36 |
37 |
|
[CA]L:152 |
1 |
1 |
85 |
◊ |
T |
x,y,z |
1_555 |
1 |
1 |
11184 |
2.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
| 37 |
38 |
|
[CA]L:146 |
1 |
1 |
85 |
f |
[MG]L:145 |
x,y,z |
1_555 |
1 |
1 |
98 |
1.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.005 |
| 38 |
39 |
|
T |
1 |
1 |
11184 |
◊ |
[CA]L:146 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
85 |
1.8 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|