## |
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 |
|
E |
100 |
23 |
7319 |
◊ |
B |
-x,y,-z |
2_555 |
97 |
23 |
7320 |
957.1 |
-13.9 |
0.138 |
10 |
4 |
0 |
1.000 |
2 |
|
J |
98 |
25 |
7503 |
◊ |
G |
-x,y,-z+1 |
2_556 |
97 |
23 |
7310 |
944.4 |
-13.1 |
0.158 |
11 |
4 |
0 |
1.000 |
3 |
|
I |
94 |
23 |
7441 |
◊ |
H |
-x,y,-z+1 |
2_556 |
97 |
23 |
7367 |
924.9 |
-13.2 |
0.126 |
10 |
3 |
0 |
1.000 |
4 |
|
F |
91 |
22 |
7471 |
◊ |
F |
-x,y,-z+1 |
2_556 |
91 |
22 |
7471 |
921.5 |
-13.1 |
0.186 |
12 |
4 |
0 |
1.000 |
5 |
|
D |
93 |
23 |
7358 |
◊ |
C |
-x,y,-z |
2_555 |
94 |
22 |
7328 |
920.6 |
-12.4 |
0.183 |
9 |
4 |
0 |
1.000 |
6 |
|
A |
96 |
22 |
7380 |
◊ |
A |
-x,y,-z |
2_555 |
95 |
22 |
7380 |
912.0 |
-13.3 |
0.205 |
12 |
6 |
0 |
1.000 |
Average: |
930.1 |
-13.2 |
0.166 |
11 |
4 |
0 |
1.000 |
2 |
7 |
|
H |
79 |
25 |
7367 |
◊ |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
64 |
21 |
7310 |
653.6 |
-6.1 |
0.401 |
3 |
0 |
0 |
0.000 |
8 |
|
C |
77 |
23 |
7328 |
◊ |
B |
-x-1/2,y-1/2,-z |
4_445 |
66 |
18 |
7320 |
613.8 |
-6.4 |
0.445 |
3 |
0 |
0 |
0.000 |
Average: |
633.7 |
-6.3 |
0.423 |
3 |
0 |
0 |
0.000 |
3 |
9 |
|
J |
59 |
19 |
7503 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
65 |
20 |
7310 |
569.3 |
0.7 |
0.788 |
5 |
3 |
0 |
0.000 |
10 |
|
B |
54 |
15 |
7320 |
◊ |
E |
x-1/2,y+1/2,z |
3_455 |
47 |
17 |
7319 |
436.9 |
-1.5 |
0.712 |
4 |
4 |
0 |
0.000 |
Average: |
503.1 |
-0.4 |
0.750 |
5 |
4 |
0 |
0.000 |
4 |
11 |
|
B |
59 |
17 |
7320 |
◊ |
A |
-x,y,-z |
2_555 |
56 |
17 |
7380 |
567.8 |
-7.9 |
0.238 |
0 |
0 |
0 |
0.250 |
12 |
|
I |
58 |
17 |
7441 |
◊ |
I |
-x,y,-z+1 |
2_556 |
57 |
17 |
7441 |
563.4 |
-8.7 |
0.151 |
0 |
0 |
0 |
0.250 |
13 |
|
D |
59 |
17 |
7358 |
◊ |
D |
-x,y,-z |
2_555 |
59 |
17 |
7358 |
552.2 |
-9.7 |
0.120 |
0 |
0 |
0 |
0.250 |
14 |
|
G |
56 |
17 |
7310 |
◊ |
F |
-x,y,-z+1 |
2_556 |
56 |
16 |
7471 |
544.4 |
-8.0 |
0.237 |
1 |
0 |
0 |
0.250 |
15 |
|
J |
60 |
17 |
7503 |
◊ |
H |
-x,y,-z+1 |
2_556 |
53 |
16 |
7367 |
543.8 |
-5.8 |
0.332 |
1 |
0 |
0 |
0.250 |
16 |
|
E |
59 |
17 |
7319 |
◊ |
C |
-x,y,-z |
2_555 |
55 |
17 |
7328 |
518.2 |
-7.3 |
0.268 |
0 |
0 |
0 |
0.250 |
Average: |
548.3 |
-7.9 |
0.224 |
0 |
0 |
0 |
0.250 |
5 |
17 |
|
H |
64 |
18 |
7367 |
◊ |
E |
x,y,z |
1_555 |
59 |
18 |
7319 |
521.8 |
-6.7 |
0.311 |
5 |
0 |
0 |
0.000 |
6 |
18 |
|
D |
49 |
16 |
7358 |
◊ |
F |
x,y-1,z |
1_545 |
55 |
18 |
7471 |
498.0 |
-5.7 |
0.378 |
5 |
2 |
0 |
0.000 |
7 |
19 |
|
J |
68 |
15 |
7503 |
◊ |
E |
x-1/2,y+1/2,z |
3_455 |
56 |
13 |
7319 |
470.8 |
-3.8 |
0.558 |
8 |
0 |
0 |
0.000 |
8 |
20 |
|
D |
55 |
16 |
7358 |
◊ |
C |
x,y,z |
1_555 |
50 |
13 |
7328 |
456.8 |
-1.0 |
0.733 |
8 |
1 |
0 |
0.269 |
21 |
|
B |
59 |
17 |
7320 |
◊ |
A |
x,y,z |
1_555 |
54 |
15 |
7380 |
453.4 |
-1.4 |
0.742 |
8 |
0 |
0 |
0.269 |
22 |
|
H |
54 |
16 |
7367 |
◊ |
G |
x,y,z |
1_555 |
51 |
15 |
7310 |
449.4 |
-1.6 |
0.664 |
5 |
2 |
0 |
0.269 |
23 |
|
I |
55 |
16 |
7441 |
◊ |
H |
x,y,z |
1_555 |
46 |
12 |
7367 |
444.1 |
-0.5 |
0.719 |
5 |
0 |
0 |
0.269 |
24 |
|
G |
52 |
16 |
7310 |
◊ |
F |
x,y,z |
1_555 |
52 |
14 |
7471 |
443.3 |
-1.1 |
0.744 |
6 |
0 |
0 |
0.269 |
25 |
|
E |
55 |
16 |
7319 |
◊ |
D |
x,y,z |
1_555 |
51 |
14 |
7358 |
442.7 |
-1.4 |
0.702 |
5 |
2 |
0 |
0.269 |
26 |
|
J |
54 |
16 |
7503 |
◊ |
I |
x,y,z |
1_555 |
52 |
17 |
7441 |
440.9 |
-2.0 |
0.624 |
6 |
2 |
0 |
0.269 |
27 |
|
E |
50 |
15 |
7319 |
◊ |
A |
x,y,z |
1_555 |
51 |
15 |
7380 |
435.2 |
-0.8 |
0.746 |
4 |
0 |
0 |
0.269 |
28 |
|
J |
49 |
13 |
7503 |
◊ |
F |
x,y,z |
1_555 |
58 |
16 |
7471 |
435.1 |
-1.3 |
0.712 |
7 |
1 |
0 |
0.269 |
29 |
|
C |
53 |
16 |
7328 |
◊ |
B |
x,y,z |
1_555 |
46 |
13 |
7320 |
424.9 |
-2.7 |
0.625 |
6 |
1 |
0 |
0.269 |
Average: |
442.6 |
-1.4 |
0.701 |
6 |
1 |
0 |
0.269 |
9 |
30 |
|
J |
55 |
19 |
7503 |
◊ |
B |
x,y,z |
1_555 |
61 |
19 |
7320 |
451.9 |
-3.4 |
0.590 |
0 |
0 |
0 |
0.000 |
10 |
31 |
|
I |
40 |
10 |
7441 |
◊ |
F |
x,y-1,z |
1_545 |
35 |
12 |
7471 |
352.7 |
-1.8 |
0.563 |
2 |
0 |
0 |
0.000 |
32 |
|
D |
27 |
7 |
7358 |
◊ |
A |
x,y-1,z |
1_545 |
19 |
6 |
7380 |
204.7 |
-2.5 |
0.394 |
0 |
0 |
0 |
0.000 |
Average: |
278.7 |
-2.2 |
0.478 |
1 |
0 |
0 |
0.000 |
11 |
33 |
|
I |
33 |
7 |
7441 |
◊ |
E |
x,y,z |
1_555 |
34 |
10 |
7319 |
302.7 |
-1.4 |
0.609 |
0 |
4 |
0 |
0.000 |
34 |
|
H |
35 |
9 |
7367 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
7380 |
301.2 |
-1.8 |
0.558 |
1 |
2 |
0 |
0.000 |
Average: |
302.0 |
-1.6 |
0.583 |
1 |
3 |
0 |
0.000 |
12 |
35 |
|
J |
29 |
9 |
7503 |
◊ |
C |
x,y,z |
1_555 |
33 |
9 |
7328 |
267.2 |
-2.6 |
0.497 |
1 |
0 |
0 |
0.000 |
13 |
36 |
|
F |
28 |
7 |
7471 |
◊ |
B |
x,y,z |
1_555 |
28 |
6 |
7320 |
265.7 |
-1.4 |
0.599 |
3 |
1 |
0 |
0.000 |
14 |
37 |
|
C |
25 |
8 |
7328 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
27 |
10 |
7380 |
264.3 |
-0.2 |
0.683 |
3 |
1 |
0 |
0.000 |
38 |
|
F |
30 |
9 |
7471 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
22 |
7 |
7367 |
263.6 |
0.6 |
0.785 |
3 |
0 |
0 |
0.000 |
Average: |
263.9 |
0.2 |
0.734 |
3 |
1 |
0 |
0.000 |
15 |
39 |
|
J |
18 |
5 |
7503 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
26 |
8 |
7367 |
189.4 |
-0.9 |
0.608 |
1 |
0 |
0 |
0.000 |
40 |
|
C |
19 |
5 |
7328 |
◊ |
E |
x-1/2,y-1/2,z |
3_445 |
14 |
4 |
7319 |
115.6 |
-1.8 |
0.447 |
0 |
0 |
0 |
0.000 |
Average: |
152.5 |
-1.4 |
0.528 |
1 |
0 |
0 |
0.000 |
16 |
41 |
|
F |
19 |
9 |
7471 |
◊ |
E |
x-1/2,y+1/2,z |
3_455 |
19 |
5 |
7319 |
167.3 |
-0.6 |
0.654 |
3 |
3 |
0 |
0.000 |
17 |
42 |
|
I |
24 |
10 |
7441 |
◊ |
D |
x,y,z |
1_555 |
19 |
7 |
7358 |
165.4 |
-0.8 |
0.618 |
0 |
0 |
0 |
0.000 |
18 |
43 |
|
[FUC]G:1141 |
11 |
1 |
291 |
◊ |
G |
x,y,z |
1_555 |
33 |
12 |
7310 |
163.0 |
2.6 |
0.559 |
4 |
0 |
0 |
0.000 |
44 |
|
[FUC]A:1141 |
11 |
1 |
291 |
◊ |
A |
x,y,z |
1_555 |
31 |
11 |
7380 |
162.8 |
2.8 |
0.552 |
4 |
0 |
0 |
0.000 |
45 |
|
[FUC]J:1141 |
11 |
1 |
290 |
◊ |
J |
x,y,z |
1_555 |
31 |
11 |
7503 |
161.8 |
3.0 |
0.574 |
5 |
0 |
0 |
0.000 |
46 |
|
[FUC]I:1141 |
11 |
1 |
292 |
◊ |
I |
x,y,z |
1_555 |
29 |
11 |
7441 |
161.1 |
3.4 |
0.616 |
4 |
0 |
0 |
0.000 |
47 |
|
[FUC]C:1141 |
11 |
1 |
290 |
◊ |
C |
x,y,z |
1_555 |
31 |
12 |
7328 |
160.7 |
3.4 |
0.629 |
4 |
0 |
0 |
0.000 |
48 |
|
[FUC]H:1141 |
11 |
1 |
289 |
◊ |
H |
x,y,z |
1_555 |
30 |
11 |
7367 |
160.5 |
2.7 |
0.525 |
4 |
0 |
0 |
0.000 |
49 |
|
[FUC]B:1141 |
11 |
1 |
291 |
◊ |
B |
x,y,z |
1_555 |
35 |
12 |
7320 |
160.4 |
2.6 |
0.571 |
4 |
0 |
0 |
0.000 |
50 |
|
[FUC]D:1141 |
11 |
1 |
290 |
◊ |
D |
x,y,z |
1_555 |
34 |
12 |
7358 |
159.4 |
2.9 |
0.560 |
3 |
0 |
0 |
0.000 |
51 |
|
[FUC]F:1141 |
11 |
1 |
290 |
◊ |
F |
x,y,z |
1_555 |
31 |
12 |
7471 |
158.9 |
2.8 |
0.613 |
4 |
0 |
0 |
0.000 |
52 |
|
[FUC]E:1141 |
11 |
1 |
290 |
◊ |
E |
x,y,z |
1_555 |
35 |
12 |
7319 |
158.9 |
2.9 |
0.568 |
3 |
0 |
0 |
0.000 |
Average: |
160.8 |
2.9 |
0.577 |
4 |
0 |
0 |
0.000 |
19 |
53 |
|
F |
14 |
4 |
7471 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
7380 |
135.6 |
-0.6 |
0.666 |
0 |
0 |
0 |
0.000 |
20 |
54 |
|
I |
13 |
4 |
7441 |
◊ |
C |
x,y,z |
1_555 |
11 |
3 |
7328 |
84.4 |
-1.0 |
0.520 |
0 |
0 |
0 |
0.000 |
21 |
55 |
|
[FUC]C:1141 |
5 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
7320 |
72.3 |
1.3 |
0.463 |
2 |
0 |
0 |
0.100 |
56 |
|
[FUC]G:1141 |
6 |
1 |
291 |
f |
F |
x,y,z |
1_555 |
10 |
3 |
7471 |
72.3 |
0.6 |
0.377 |
1 |
0 |
0 |
0.100 |
57 |
|
[FUC]I:1141 |
6 |
1 |
292 |
f |
H |
x,y,z |
1_555 |
10 |
3 |
7367 |
72.3 |
0.6 |
0.361 |
1 |
0 |
0 |
0.100 |
58 |
|
[FUC]E:1141 |
6 |
1 |
290 |
f |
D |
x,y,z |
1_555 |
10 |
3 |
7358 |
71.5 |
0.6 |
0.352 |
1 |
0 |
0 |
0.100 |
59 |
|
[FUC]F:1141 |
6 |
1 |
290 |
f |
J |
x,y,z |
1_555 |
10 |
3 |
7503 |
71.3 |
0.5 |
0.371 |
1 |
0 |
0 |
0.100 |
60 |
|
[FUC]D:1141 |
6 |
1 |
290 |
f |
C |
x,y,z |
1_555 |
10 |
3 |
7328 |
71.2 |
0.5 |
0.350 |
2 |
0 |
0 |
0.100 |
61 |
|
[FUC]B:1141 |
5 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
7380 |
70.9 |
0.6 |
0.410 |
1 |
0 |
0 |
0.100 |
62 |
|
[FUC]A:1141 |
5 |
1 |
291 |
f |
E |
x,y,z |
1_555 |
9 |
3 |
7319 |
70.2 |
0.6 |
0.369 |
1 |
0 |
0 |
0.100 |
63 |
|
[FUC]H:1141 |
6 |
1 |
289 |
f |
G |
x,y,z |
1_555 |
10 |
3 |
7310 |
69.3 |
1.3 |
0.419 |
2 |
0 |
0 |
0.100 |
64 |
|
[FUC]J:1141 |
6 |
1 |
290 |
f |
I |
x,y,z |
1_555 |
10 |
3 |
7441 |
67.9 |
0.6 |
0.381 |
2 |
0 |
0 |
0.100 |
Average: |
70.9 |
0.7 |
0.385 |
1 |
0 |
0 |
0.100 |
22 |
65 |
|
I |
6 |
2 |
7441 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
11 |
4 |
7310 |
67.4 |
-0.5 |
0.514 |
0 |
0 |
0 |
0.000 |
66 |
|
B |
9 |
4 |
7320 |
◊ |
D |
x-1/2,y+1/2,z |
3_455 |
6 |
2 |
7358 |
57.9 |
-0.5 |
0.512 |
0 |
0 |
0 |
0.000 |
Average: |
62.7 |
-0.5 |
0.513 |
0 |
0 |
0 |
0.000 |
23 |
67 |
|
D |
13 |
5 |
7358 |
◊ |
G |
x,y-1,z |
1_545 |
8 |
4 |
7310 |
56.9 |
-0.1 |
0.661 |
0 |
0 |
0 |
0.000 |
24 |
68 |
|
G |
8 |
3 |
7310 |
◊ |
A |
x,y,z |
1_555 |
16 |
9 |
7380 |
54.4 |
1.3 |
0.813 |
0 |
0 |
0 |
0.000 |
25 |
69 |
|
C |
2 |
2 |
7328 |
◊ |
H |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
7367 |
13.6 |
0.3 |
0.787 |
0 |
0 |
0 |
0.000 |
26 |
70 |
|
I |
1 |
1 |
7441 |
◊ |
F |
-x,y-1,-z+1 |
2_546 |
1 |
1 |
7471 |
1.3 |
0.1 |
0.742 |
0 |
0 |
0 |
0.000 |
|