| ## |
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 |
|
D |
110 |
27 |
4885 |
◊ |
A |
x,y,z |
1_555 |
145 |
36 |
20726 |
1179.1 |
-10.3 |
0.124 |
15 |
2 |
0 |
1.000 |
2 |
|
N |
108 |
27 |
4894 |
◊ |
K |
x,y,z |
1_555 |
145 |
34 |
20773 |
1173.1 |
-10.3 |
0.121 |
15 |
4 |
0 |
1.000 |
3 |
|
M |
107 |
27 |
4895 |
◊ |
J |
x,y,z |
1_555 |
143 |
35 |
20737 |
1166.0 |
-10.2 |
0.121 |
15 |
2 |
0 |
1.000 |
4 |
|
F |
108 |
26 |
4894 |
◊ |
C |
x,y,z |
1_555 |
143 |
34 |
20480 |
1165.9 |
-11.1 |
0.092 |
14 |
2 |
0 |
1.000 |
5 |
|
O |
108 |
27 |
4897 |
◊ |
L |
x,y,z |
1_555 |
143 |
33 |
20545 |
1165.1 |
-10.2 |
0.123 |
14 |
2 |
0 |
1.000 |
6 |
|
E |
109 |
26 |
4893 |
◊ |
B |
x,y,z |
1_555 |
146 |
33 |
20727 |
1146.5 |
-10.2 |
0.126 |
15 |
5 |
0 |
1.000 |
| Average: |
1165.9 |
-10.4 |
0.117 |
15 |
3 |
0 |
1.000 |
| 2 |
7 |
|
C |
115 |
37 |
20480 |
◊ |
A |
x,y,z |
1_555 |
114 |
34 |
20726 |
1095.4 |
-12.4 |
0.117 |
8 |
7 |
0 |
1.000 |
8 |
|
L |
108 |
36 |
20545 |
◊ |
J |
x,y,z |
1_555 |
111 |
32 |
20737 |
1072.6 |
-11.4 |
0.136 |
4 |
7 |
0 |
1.000 |
9 |
|
B |
113 |
33 |
20727 |
◊ |
A |
x,y,z |
1_555 |
108 |
35 |
20726 |
1063.1 |
-12.8 |
0.102 |
4 |
8 |
0 |
1.000 |
10 |
|
K |
108 |
31 |
20773 |
◊ |
J |
x,y,z |
1_555 |
105 |
34 |
20737 |
1015.5 |
-12.3 |
0.104 |
3 |
7 |
0 |
1.000 |
11 |
|
L |
106 |
30 |
20545 |
◊ |
K |
x,y,z |
1_555 |
100 |
33 |
20773 |
978.7 |
-11.7 |
0.115 |
4 |
4 |
0 |
1.000 |
| Average: |
1045.1 |
-12.1 |
0.115 |
5 |
7 |
0 |
1.000 |
| 3 |
12 |
|
I |
110 |
29 |
4768 |
◊ |
C |
x,y,z |
1_555 |
114 |
36 |
20480 |
1087.5 |
-6.6 |
0.291 |
9 |
2 |
0 |
0.024 |
13 |
|
R |
106 |
27 |
4765 |
◊ |
L |
x,y,z |
1_555 |
112 |
35 |
20545 |
1068.8 |
-6.6 |
0.288 |
10 |
2 |
0 |
0.024 |
14 |
|
H |
100 |
27 |
4773 |
◊ |
B |
x,y,z |
1_555 |
115 |
38 |
20727 |
1052.8 |
-6.6 |
0.291 |
6 |
1 |
0 |
0.024 |
15 |
|
Q |
102 |
27 |
4769 |
◊ |
K |
x,y,z |
1_555 |
113 |
37 |
20773 |
1052.1 |
-6.7 |
0.281 |
6 |
1 |
0 |
0.024 |
16 |
|
P |
101 |
26 |
4773 |
◊ |
J |
x,y,z |
1_555 |
112 |
36 |
20737 |
1049.8 |
-6.5 |
0.289 |
8 |
2 |
0 |
0.024 |
17 |
|
G |
98 |
27 |
4779 |
◊ |
A |
x,y,z |
1_555 |
110 |
36 |
20726 |
1008.2 |
-6.5 |
0.279 |
7 |
1 |
0 |
0.024 |
| Average: |
1053.2 |
-6.6 |
0.286 |
8 |
2 |
0 |
0.024 |
| 4 |
18 |
|
C |
106 |
31 |
20480 |
◊ |
B |
x,y,z |
1_555 |
103 |
36 |
20727 |
1016.2 |
-11.9 |
0.113 |
4 |
4 |
0 |
0.304 |
| 5 |
19 |
|
K |
50 |
13 |
20773 |
◊ |
L |
-x,y-1/2,-z-1 |
2_544 |
57 |
18 |
20545 |
482.5 |
4.9 |
0.913 |
7 |
6 |
0 |
0.000 |
20 |
|
B |
50 |
13 |
20727 |
◊ |
C |
-x-1,y-1/2,-z |
2_445 |
56 |
18 |
20480 |
459.5 |
4.9 |
0.908 |
8 |
4 |
0 |
0.000 |
| Average: |
471.0 |
4.9 |
0.910 |
8 |
5 |
0 |
0.000 |
| 6 |
21 |
|
D |
37 |
12 |
4885 |
◊ |
K |
-x,y-1/2,-z |
2_545 |
48 |
16 |
20773 |
391.5 |
0.9 |
0.669 |
5 |
8 |
0 |
0.000 |
22 |
|
M |
37 |
11 |
4895 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
36 |
11 |
20727 |
312.1 |
0.9 |
0.654 |
2 |
0 |
0 |
0.000 |
| Average: |
351.8 |
0.9 |
0.662 |
4 |
4 |
0 |
0.000 |
| 7 |
23 |
|
C |
31 |
9 |
20480 |
◊ |
N |
x-1,y,z |
1_455 |
33 |
8 |
4894 |
292.9 |
-0.3 |
0.545 |
1 |
0 |
0 |
0.000 |
24 |
|
E |
33 |
8 |
4893 |
◊ |
L |
x-1,y,z |
1_455 |
31 |
9 |
20545 |
289.6 |
-0.3 |
0.549 |
2 |
0 |
0 |
0.000 |
| Average: |
291.2 |
-0.3 |
0.547 |
2 |
0 |
0 |
0.000 |
| 8 |
25 |
|
Q |
29 |
9 |
4769 |
◊ |
H |
x,y,z |
1_555 |
28 |
10 |
4773 |
267.6 |
1.0 |
0.651 |
7 |
2 |
0 |
0.000 |
| 9 |
26 |
|
K |
29 |
9 |
20773 |
◊ |
A |
x,y,z |
1_555 |
34 |
12 |
20726 |
265.5 |
-1.2 |
0.524 |
0 |
1 |
0 |
0.000 |
27 |
|
J |
33 |
8 |
20737 |
◊ |
B |
x,y,z |
1_555 |
29 |
8 |
20727 |
249.4 |
-1.2 |
0.526 |
0 |
0 |
0 |
0.000 |
| Average: |
257.4 |
-1.2 |
0.525 |
0 |
1 |
0 |
0.000 |
| 10 |
28 |
|
L |
27 |
8 |
20545 |
◊ |
A |
x,y,z-1 |
1_554 |
32 |
10 |
20726 |
249.1 |
0.3 |
0.680 |
1 |
1 |
0 |
0.000 |
29 |
|
J |
27 |
10 |
20737 |
◊ |
C |
x,y,z-1 |
1_554 |
23 |
6 |
20480 |
212.7 |
-0.0 |
0.628 |
2 |
0 |
0 |
0.000 |
| Average: |
230.9 |
0.1 |
0.654 |
2 |
1 |
0 |
0.000 |
| 11 |
30 |
|
C |
29 |
13 |
20480 |
x |
C |
-x-1,y-1/2,-z |
2_445 |
25 |
9 |
20480 |
207.8 |
3.1 |
0.890 |
2 |
1 |
0 |
0.000 |
31 |
|
L |
23 |
12 |
20545 |
x |
L |
-x,y-1/2,-z-1 |
2_544 |
23 |
8 |
20545 |
163.7 |
2.9 |
0.890 |
2 |
1 |
0 |
0.000 |
| Average: |
185.7 |
3.0 |
0.890 |
2 |
1 |
0 |
0.000 |
| 12 |
32 |
|
H |
15 |
4 |
4773 |
◊ |
C |
x,y,z |
1_555 |
21 |
7 |
20480 |
194.7 |
0.9 |
0.369 |
6 |
0 |
0 |
0.001 |
33 |
|
Q |
15 |
4 |
4769 |
◊ |
L |
x,y,z |
1_555 |
21 |
7 |
20545 |
194.6 |
0.9 |
0.361 |
6 |
0 |
0 |
0.001 |
| Average: |
194.7 |
0.9 |
0.365 |
6 |
0 |
0 |
0.001 |
| 13 |
34 |
|
I |
17 |
9 |
4768 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
25 |
8 |
20726 |
172.5 |
-0.9 |
0.477 |
0 |
0 |
0 |
0.000 |
| 14 |
35 |
|
R |
17 |
5 |
4765 |
◊ |
J |
-x,y-1/2,-z-1 |
2_544 |
20 |
7 |
20737 |
161.2 |
-0.5 |
0.524 |
0 |
0 |
0 |
0.000 |
| 15 |
36 |
|
P |
13 |
4 |
4773 |
◊ |
K |
x,y,z |
1_555 |
20 |
6 |
20773 |
156.2 |
0.9 |
0.470 |
3 |
0 |
0 |
0.000 |
37 |
|
G |
13 |
4 |
4779 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
20727 |
150.3 |
0.8 |
0.476 |
3 |
0 |
0 |
0.000 |
38 |
|
I |
13 |
4 |
4768 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
20726 |
146.4 |
0.9 |
0.499 |
1 |
0 |
0 |
0.000 |
39 |
|
R |
13 |
4 |
4765 |
◊ |
J |
x,y,z |
1_555 |
17 |
5 |
20737 |
127.7 |
0.9 |
0.549 |
1 |
0 |
0 |
0.000 |
| Average: |
145.2 |
0.9 |
0.498 |
2 |
0 |
0 |
0.000 |
| 16 |
40 |
|
H |
16 |
6 |
4773 |
◊ |
E |
x,y,z |
1_555 |
22 |
7 |
4893 |
153.5 |
1.0 |
0.674 |
1 |
2 |
0 |
0.000 |
41 |
|
Q |
15 |
6 |
4769 |
◊ |
N |
x,y,z |
1_555 |
20 |
6 |
4894 |
147.6 |
1.0 |
0.673 |
1 |
2 |
0 |
0.000 |
42 |
|
I |
20 |
7 |
4768 |
◊ |
F |
x,y,z |
1_555 |
21 |
5 |
4894 |
142.0 |
0.9 |
0.644 |
2 |
2 |
0 |
0.000 |
43 |
|
P |
20 |
7 |
4773 |
◊ |
M |
x,y,z |
1_555 |
19 |
5 |
4895 |
141.6 |
1.1 |
0.668 |
2 |
2 |
0 |
0.000 |
44 |
|
R |
19 |
7 |
4765 |
◊ |
O |
x,y,z |
1_555 |
19 |
5 |
4897 |
134.3 |
0.8 |
0.635 |
2 |
2 |
0 |
0.000 |
45 |
|
G |
14 |
7 |
4779 |
◊ |
D |
x,y,z |
1_555 |
19 |
5 |
4885 |
128.9 |
0.8 |
0.640 |
2 |
2 |
0 |
0.000 |
| Average: |
141.3 |
0.9 |
0.656 |
2 |
2 |
0 |
0.000 |
| 17 |
46 |
|
A |
19 |
7 |
20726 |
◊ |
C |
-x-1,y-1/2,-z |
2_445 |
17 |
8 |
20480 |
150.3 |
1.1 |
0.766 |
1 |
1 |
0 |
0.000 |
47 |
|
J |
11 |
6 |
20737 |
◊ |
L |
-x,y-1/2,-z-1 |
2_544 |
12 |
8 |
20545 |
96.3 |
1.6 |
0.741 |
0 |
1 |
0 |
0.000 |
| Average: |
123.3 |
1.4 |
0.754 |
1 |
1 |
0 |
0.000 |
| 18 |
48 |
|
J |
20 |
4 |
20737 |
◊ |
A |
x,y,z-1 |
1_554 |
15 |
4 |
20726 |
141.1 |
0.0 |
0.635 |
1 |
0 |
0 |
0.000 |
| 19 |
49 |
|
G |
17 |
6 |
4779 |
◊ |
K |
-x,y-1/2,-z |
2_545 |
14 |
5 |
20773 |
123.0 |
0.5 |
0.625 |
1 |
0 |
0 |
0.000 |
| 20 |
50 |
|
L |
15 |
5 |
20545 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
17 |
6 |
20726 |
114.0 |
0.5 |
0.692 |
1 |
0 |
0 |
0.000 |
51 |
|
C |
14 |
6 |
20480 |
◊ |
J |
-x-1,y-1/2,-z-1 |
2_444 |
12 |
3 |
20737 |
107.2 |
0.3 |
0.671 |
0 |
0 |
0 |
0.000 |
| Average: |
110.6 |
0.4 |
0.682 |
1 |
0 |
0 |
0.000 |
| 21 |
52 |
|
E |
11 |
4 |
4893 |
◊ |
J |
-x-1,y-1/2,-z-1 |
2_444 |
11 |
3 |
20737 |
112.6 |
0.2 |
0.590 |
0 |
0 |
0 |
0.000 |
53 |
|
N |
6 |
2 |
4894 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
10 |
3 |
20726 |
66.9 |
0.7 |
0.739 |
0 |
0 |
0 |
0.000 |
| Average: |
89.7 |
0.5 |
0.665 |
0 |
0 |
0 |
0.000 |
| 22 |
54 |
|
P |
15 |
5 |
4773 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
10 |
4 |
20727 |
104.4 |
1.2 |
0.758 |
1 |
1 |
0 |
0.000 |
| 23 |
55 |
|
P |
12 |
4 |
4773 |
◊ |
G |
x,y,z-1 |
1_554 |
11 |
4 |
4779 |
92.3 |
-0.7 |
0.412 |
0 |
0 |
0 |
0.000 |
| 24 |
56 |
|
K |
9 |
3 |
20773 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
20727 |
66.7 |
0.4 |
0.701 |
0 |
0 |
0 |
0.000 |
| 25 |
57 |
|
O |
6 |
2 |
4897 |
◊ |
B |
-x,y-1/2,-z-1 |
2_544 |
7 |
4 |
20727 |
65.7 |
0.3 |
0.650 |
0 |
1 |
0 |
0.000 |
| 26 |
58 |
|
E |
7 |
5 |
4893 |
◊ |
J |
x,y,z |
1_555 |
7 |
3 |
20737 |
62.8 |
0.6 |
0.589 |
1 |
0 |
0 |
0.000 |
59 |
|
N |
7 |
4 |
4894 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
20726 |
62.5 |
0.7 |
0.700 |
1 |
0 |
0 |
0.000 |
| Average: |
62.7 |
0.6 |
0.644 |
1 |
0 |
0 |
0.000 |
| 27 |
60 |
|
F |
5 |
2 |
4894 |
◊ |
K |
-x-1,y-1/2,-z |
2_445 |
3 |
1 |
20773 |
49.9 |
0.1 |
0.535 |
1 |
2 |
0 |
0.000 |
| 28 |
61 |
|
Q |
6 |
2 |
4769 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
20727 |
41.6 |
0.3 |
0.670 |
0 |
0 |
0 |
0.000 |
62 |
|
H |
5 |
2 |
4773 |
◊ |
K |
x,y,z |
1_555 |
6 |
4 |
20773 |
22.8 |
0.4 |
0.702 |
0 |
0 |
0 |
0.000 |
| Average: |
32.2 |
0.4 |
0.686 |
0 |
0 |
0 |
0.000 |
| 29 |
63 |
|
F |
6 |
3 |
4894 |
◊ |
O |
x-1,y,z+1 |
1_456 |
6 |
3 |
4897 |
30.1 |
0.8 |
0.735 |
0 |
0 |
0 |
0.000 |
| 30 |
64 |
|
N |
1 |
1 |
4894 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
4885 |
9.3 |
0.3 |
0.804 |
0 |
0 |
0 |
0.000 |
| 31 |
65 |
|
C |
1 |
1 |
20480 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
3 |
1 |
20727 |
7.6 |
0.2 |
0.764 |
0 |
0 |
0 |
0.000 |
| 32 |
66 |
|
C |
4 |
2 |
20480 |
◊ |
K |
x-1,y,z |
1_455 |
2 |
2 |
20773 |
7.3 |
0.0 |
0.626 |
0 |
0 |
0 |
0.000 |
67 |
|
B |
1 |
1 |
20727 |
◊ |
L |
x-1,y,z |
1_455 |
2 |
1 |
20545 |
1.0 |
0.0 |
0.673 |
0 |
0 |
0 |
0.000 |
| Average: |
4.2 |
0.0 |
0.650 |
0 |
0 |
0 |
0.000 |
| 33 |
68 |
|
O |
1 |
1 |
4897 |
◊ |
K |
-x,y-1/2,-z-1 |
2_544 |
1 |
1 |
20773 |
4.2 |
0.2 |
0.806 |
0 |
0 |
0 |
0.000 |
| 34 |
69 |
|
F |
1 |
1 |
4894 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
20727 |
3.1 |
0.2 |
0.777 |
0 |
0 |
0 |
0.000 |
|