## |
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 |
|
H |
205 |
65 |
13786 |
◊ |
G |
x,y,z |
1_555 |
217 |
66 |
12438 |
2010.3 |
-24.3 |
0.125 |
21 |
4 |
1 |
1.000 |
2 |
|
L |
203 |
63 |
13967 |
◊ |
F |
x,y,z |
1_555 |
213 |
61 |
12387 |
1880.1 |
-30.1 |
0.064 |
23 |
6 |
1 |
1.000 |
3 |
|
B |
207 |
63 |
14102 |
◊ |
A |
x,y,z |
1_555 |
193 |
58 |
12576 |
1854.3 |
-25.3 |
0.086 |
20 |
5 |
1 |
1.000 |
4 |
|
Q |
209 |
65 |
13969 |
◊ |
P |
x,y,z |
1_555 |
182 |
60 |
11726 |
1847.9 |
-26.6 |
0.073 |
17 |
2 |
1 |
1.000 |
Average: |
1898.2 |
-26.6 |
0.087 |
20 |
4 |
1 |
1.000 |
2 |
5 |
|
U |
115 |
29 |
6929 |
◊ |
R |
x,y,z |
1_555 |
125 |
38 |
15693 |
1133.0 |
-11.3 |
0.217 |
6 |
6 |
0 |
0.467 |
6 |
|
D |
119 |
30 |
7154 |
◊ |
C |
x,y,z |
1_555 |
131 |
37 |
16311 |
1101.4 |
-10.0 |
0.251 |
8 |
4 |
0 |
0.467 |
7 |
|
J |
106 |
27 |
6635 |
◊ |
I |
x,y,z |
1_555 |
110 |
37 |
16324 |
1028.2 |
-6.1 |
0.408 |
8 |
9 |
0 |
0.467 |
8 |
|
N |
99 |
32 |
6859 |
◊ |
M |
x,y,z |
1_555 |
113 |
36 |
16749 |
998.9 |
-6.0 |
0.446 |
8 |
0 |
0 |
0.467 |
Average: |
1065.4 |
-8.3 |
0.331 |
8 |
5 |
0 |
0.467 |
3 |
9 |
|
Q |
105 |
31 |
13969 |
◊ |
B |
x,y,z-1 |
1_554 |
102 |
31 |
14102 |
912.3 |
-2.2 |
0.808 |
6 |
0 |
0 |
0.000 |
4 |
10 |
|
T |
54 |
9 |
1281 |
◊ |
R |
x,y,z |
1_555 |
107 |
34 |
15693 |
829.0 |
-12.2 |
0.507 |
10 |
2 |
0 |
1.000 |
11 |
|
E |
57 |
9 |
1257 |
◊ |
C |
x,y,z |
1_555 |
118 |
33 |
16311 |
825.8 |
-12.4 |
0.508 |
10 |
1 |
0 |
1.000 |
12 |
|
O |
52 |
9 |
1255 |
◊ |
M |
x,y,z |
1_555 |
113 |
33 |
16749 |
786.8 |
-15.9 |
0.243 |
5 |
2 |
0 |
1.000 |
13 |
|
K |
54 |
9 |
1263 |
◊ |
I |
x,y,z |
1_555 |
116 |
32 |
16324 |
773.9 |
-15.4 |
0.262 |
9 |
1 |
0 |
1.000 |
Average: |
803.9 |
-14.0 |
0.380 |
9 |
2 |
0 |
1.000 |
5 |
14 |
|
P |
52 |
17 |
11726 |
◊ |
F |
x,y,z |
1_555 |
54 |
18 |
12387 |
511.0 |
-6.4 |
0.333 |
4 |
0 |
0 |
0.000 |
15 |
|
G |
46 |
16 |
12438 |
◊ |
A |
x,y,z |
1_555 |
49 |
17 |
12576 |
493.1 |
-6.8 |
0.201 |
4 |
0 |
0 |
0.000 |
Average: |
502.1 |
-6.6 |
0.267 |
4 |
0 |
0 |
0.000 |
6 |
16 |
|
C |
51 |
14 |
16311 |
◊ |
B |
x,y,z |
1_555 |
49 |
15 |
14102 |
460.2 |
-3.8 |
0.386 |
2 |
1 |
0 |
0.000 |
17 |
|
M |
50 |
15 |
16749 |
◊ |
L |
x,y,z |
1_555 |
44 |
14 |
13967 |
431.1 |
-3.2 |
0.390 |
4 |
3 |
0 |
0.000 |
18 |
|
I |
41 |
12 |
16324 |
◊ |
H |
x,y,z |
1_555 |
42 |
13 |
13786 |
413.5 |
-3.0 |
0.407 |
2 |
0 |
0 |
0.000 |
19 |
|
R |
48 |
14 |
15693 |
◊ |
Q |
x,y,z |
1_555 |
45 |
14 |
13969 |
403.1 |
-5.1 |
0.265 |
1 |
3 |
0 |
0.000 |
Average: |
427.0 |
-3.8 |
0.362 |
2 |
2 |
0 |
0.000 |
7 |
20 |
|
M |
48 |
15 |
16749 |
◊ |
F |
x,y,z |
1_555 |
45 |
16 |
12387 |
440.9 |
0.1 |
0.789 |
5 |
0 |
0 |
0.000 |
21 |
|
R |
52 |
15 |
15693 |
◊ |
P |
x,y,z |
1_555 |
44 |
13 |
11726 |
429.3 |
-0.2 |
0.740 |
5 |
1 |
0 |
0.000 |
22 |
|
C |
45 |
12 |
16311 |
◊ |
A |
x,y,z |
1_555 |
51 |
14 |
12576 |
417.8 |
-0.2 |
0.732 |
2 |
2 |
0 |
0.000 |
23 |
|
I |
44 |
12 |
16324 |
◊ |
G |
x,y,z |
1_555 |
46 |
10 |
12438 |
370.4 |
-0.8 |
0.659 |
2 |
0 |
0 |
0.000 |
Average: |
414.6 |
-0.3 |
0.730 |
4 |
1 |
0 |
0.000 |
8 |
24 |
|
L |
37 |
11 |
13967 |
◊ |
G |
x,y,z |
1_555 |
42 |
13 |
12438 |
368.0 |
-0.7 |
0.664 |
3 |
2 |
0 |
0.000 |
25 |
|
F |
34 |
11 |
12387 |
◊ |
H |
x-1,y,z |
1_455 |
33 |
9 |
13786 |
316.4 |
0.2 |
0.804 |
5 |
2 |
0 |
0.000 |
Average: |
342.2 |
-0.3 |
0.734 |
4 |
2 |
0 |
0.000 |
9 |
26 |
|
L |
37 |
7 |
13967 |
◊ |
A |
x,y,z |
1_555 |
36 |
12 |
12576 |
301.9 |
-1.4 |
0.633 |
2 |
2 |
0 |
0.000 |
27 |
|
P |
26 |
12 |
11726 |
◊ |
H |
x-1,y,z |
1_455 |
25 |
7 |
13786 |
226.5 |
-1.2 |
0.616 |
1 |
2 |
0 |
0.000 |
Average: |
264.2 |
-1.3 |
0.624 |
2 |
2 |
0 |
0.000 |
10 |
28 |
|
O |
24 |
6 |
1255 |
◊ |
L |
x,y,z |
1_555 |
23 |
8 |
13967 |
221.7 |
-3.5 |
0.359 |
1 |
0 |
0 |
0.000 |
29 |
|
E |
25 |
6 |
1257 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
14102 |
213.5 |
-3.5 |
0.347 |
2 |
0 |
0 |
0.000 |
30 |
|
T |
25 |
5 |
1281 |
◊ |
Q |
x,y,z |
1_555 |
25 |
10 |
13969 |
210.8 |
-3.9 |
0.241 |
2 |
0 |
0 |
0.000 |
31 |
|
K |
19 |
5 |
1263 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
13786 |
178.8 |
-4.0 |
0.185 |
1 |
0 |
0 |
0.000 |
Average: |
206.2 |
-3.7 |
0.283 |
2 |
0 |
0 |
0.000 |
11 |
32 |
|
R |
14 |
5 |
15693 |
◊ |
H |
x,y,z |
1_555 |
24 |
8 |
13786 |
203.3 |
-2.5 |
0.175 |
0 |
0 |
0 |
0.000 |
33 |
|
L |
20 |
10 |
13967 |
◊ |
C |
x-1,y,z |
1_455 |
15 |
4 |
16311 |
149.5 |
-1.6 |
0.305 |
1 |
0 |
0 |
0.000 |
Average: |
176.4 |
-2.0 |
0.240 |
1 |
0 |
0 |
0.000 |
12 |
34 |
|
R |
25 |
8 |
15693 |
◊ |
I |
x,y,z-1 |
1_554 |
22 |
8 |
16324 |
194.6 |
-0.9 |
0.377 |
1 |
0 |
0 |
0.000 |
35 |
|
M |
17 |
7 |
16749 |
◊ |
C |
x,y,z-1 |
1_554 |
18 |
7 |
16311 |
147.2 |
-1.7 |
0.334 |
1 |
0 |
0 |
0.000 |
Average: |
170.9 |
-1.3 |
0.356 |
1 |
0 |
0 |
0.000 |
13 |
36 |
|
O |
15 |
5 |
1255 |
◊ |
F |
x,y,z |
1_555 |
16 |
6 |
12387 |
110.3 |
-0.2 |
0.918 |
1 |
0 |
0 |
0.000 |
37 |
|
E |
15 |
5 |
1257 |
◊ |
A |
x,y,z |
1_555 |
15 |
4 |
12576 |
110.2 |
-0.9 |
0.809 |
3 |
0 |
0 |
0.000 |
38 |
|
K |
13 |
5 |
1263 |
◊ |
G |
x,y,z |
1_555 |
14 |
4 |
12438 |
102.4 |
-0.1 |
0.874 |
2 |
0 |
0 |
0.000 |
39 |
|
T |
15 |
5 |
1281 |
◊ |
P |
x,y,z |
1_555 |
13 |
4 |
11726 |
100.2 |
-0.2 |
0.883 |
3 |
0 |
0 |
0.000 |
Average: |
105.8 |
-0.4 |
0.871 |
2 |
0 |
0 |
0.000 |
14 |
40 |
|
P |
11 |
4 |
11726 |
◊ |
M |
x-1,y,z |
1_455 |
12 |
7 |
16749 |
104.3 |
-0.1 |
0.632 |
0 |
0 |
0 |
0.000 |
41 |
|
A |
9 |
4 |
12576 |
◊ |
I |
x-1,y,z |
1_455 |
19 |
9 |
16324 |
70.1 |
0.7 |
0.710 |
0 |
0 |
0 |
0.000 |
Average: |
87.2 |
0.3 |
0.671 |
0 |
0 |
0 |
0.000 |
15 |
42 |
|
B |
8 |
4 |
14102 |
◊ |
F |
x,y,z |
1_555 |
8 |
4 |
12387 |
76.2 |
-0.7 |
0.375 |
0 |
0 |
0 |
0.000 |
43 |
|
Q |
10 |
4 |
13969 |
◊ |
G |
x-1,y,z |
1_455 |
10 |
5 |
12438 |
60.1 |
-1.0 |
0.441 |
0 |
0 |
0 |
0.000 |
Average: |
68.1 |
-0.8 |
0.408 |
0 |
0 |
0 |
0.000 |
16 |
44 |
|
C |
9 |
3 |
16311 |
◊ |
J |
x-1,y+1,z |
1_465 |
9 |
3 |
6635 |
74.9 |
1.2 |
0.817 |
1 |
0 |
0 |
0.000 |
45 |
|
R |
3 |
2 |
15693 |
◊ |
N |
x,y-1,z |
1_545 |
5 |
2 |
6859 |
31.7 |
-0.8 |
0.286 |
0 |
0 |
0 |
0.000 |
Average: |
53.3 |
0.2 |
0.551 |
1 |
0 |
0 |
0.000 |
17 |
46 |
|
I |
14 |
5 |
16324 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
3 |
16311 |
73.8 |
-0.7 |
0.433 |
0 |
0 |
0 |
0.000 |
47 |
|
M |
5 |
3 |
16749 |
◊ |
R |
x-1,y+1,z |
1_465 |
6 |
2 |
15693 |
47.5 |
-0.5 |
0.458 |
0 |
0 |
0 |
0.000 |
Average: |
60.7 |
-0.6 |
0.446 |
0 |
0 |
0 |
0.000 |
18 |
48 |
|
M |
10 |
3 |
16749 |
◊ |
P |
x,y,z |
1_555 |
11 |
4 |
11726 |
72.6 |
0.5 |
0.731 |
0 |
0 |
0 |
0.000 |
49 |
|
C |
5 |
1 |
16311 |
◊ |
G |
x,y,z |
1_555 |
11 |
3 |
12438 |
62.3 |
0.8 |
0.763 |
0 |
0 |
0 |
0.000 |
50 |
|
R |
6 |
1 |
15693 |
◊ |
F |
x,y,z |
1_555 |
9 |
4 |
12387 |
55.1 |
0.0 |
0.678 |
0 |
0 |
0 |
0.000 |
51 |
|
I |
7 |
3 |
16324 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
12576 |
49.1 |
-0.4 |
0.511 |
0 |
0 |
0 |
0.000 |
Average: |
59.8 |
0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
19 |
52 |
|
H |
4 |
2 |
13786 |
◊ |
F |
x,y,z |
1_555 |
8 |
3 |
12387 |
59.7 |
-0.9 |
0.256 |
0 |
0 |
0 |
0.000 |
53 |
|
L |
8 |
4 |
13967 |
◊ |
G |
x-1,y,z |
1_455 |
6 |
3 |
12438 |
31.7 |
-0.5 |
0.502 |
0 |
0 |
0 |
0.000 |
Average: |
45.7 |
-0.7 |
0.379 |
0 |
0 |
0 |
0.000 |
20 |
54 |
|
U |
9 |
4 |
6929 |
◊ |
M |
x,y-1,z |
1_545 |
5 |
3 |
16749 |
37.2 |
0.2 |
0.693 |
0 |
0 |
0 |
0.000 |
55 |
|
D |
5 |
2 |
7154 |
◊ |
I |
x-1,y+1,z |
1_465 |
5 |
2 |
16324 |
30.1 |
0.2 |
0.698 |
0 |
0 |
0 |
0.000 |
Average: |
33.7 |
0.2 |
0.696 |
0 |
0 |
0 |
0.000 |
21 |
56 |
|
I |
4 |
2 |
16324 |
◊ |
M |
x,y-1,z+1 |
1_546 |
4 |
1 |
16749 |
30.1 |
0.6 |
0.789 |
0 |
0 |
0 |
0.000 |
22 |
57 |
|
Q |
3 |
1 |
13969 |
◊ |
H |
x-1,y,z |
1_455 |
4 |
2 |
13786 |
23.5 |
-0.6 |
0.344 |
0 |
0 |
0 |
0.000 |
58 |
|
L |
1 |
1 |
13967 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
14102 |
4.3 |
0.0 |
0.525 |
0 |
0 |
0 |
0.000 |
Average: |
13.9 |
-0.3 |
0.435 |
0 |
0 |
0 |
0.000 |
23 |
59 |
|
U |
4 |
2 |
6929 |
◊ |
I |
x,y,z-1 |
1_554 |
3 |
1 |
16324 |
22.5 |
-0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
24 |
60 |
|
G |
3 |
3 |
12438 |
◊ |
F |
x,y,z |
1_555 |
3 |
2 |
12387 |
18.6 |
0.3 |
0.769 |
0 |
0 |
0 |
0.000 |
61 |
|
F |
1 |
1 |
12387 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
12438 |
0.7 |
0.0 |
0.704 |
0 |
0 |
0 |
0.000 |
Average: |
9.6 |
0.2 |
0.736 |
0 |
0 |
0 |
0.000 |
25 |
62 |
|
M |
3 |
1 |
16749 |
◊ |
J |
x-1,y+1,z-1 |
1_464 |
1 |
1 |
6635 |
17.4 |
-0.0 |
0.351 |
0 |
0 |
0 |
0.000 |
63 |
|
I |
1 |
1 |
16324 |
◊ |
N |
x,y-1,z+1 |
1_546 |
1 |
1 |
6859 |
2.1 |
-0.1 |
0.461 |
0 |
0 |
0 |
0.000 |
Average: |
9.8 |
-0.0 |
0.406 |
0 |
0 |
0 |
0.000 |
26 |
64 |
|
B |
1 |
1 |
14102 |
◊ |
J |
x-1,y+1,z |
1_465 |
1 |
1 |
6635 |
8.4 |
0.5 |
0.879 |
0 |
0 |
0 |
0.000 |
65 |
|
Q |
1 |
1 |
13969 |
◊ |
N |
x,y-1,z |
1_545 |
1 |
1 |
6859 |
3.6 |
0.2 |
0.808 |
0 |
0 |
0 |
0.000 |
Average: |
6.0 |
0.3 |
0.844 |
0 |
0 |
0 |
0.000 |
27 |
66 |
|
C |
2 |
1 |
16311 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
13967 |
8.4 |
-0.2 |
0.464 |
0 |
0 |
0 |
0.000 |
67 |
|
R |
2 |
1 |
15693 |
◊ |
H |
x-1,y,z |
1_455 |
1 |
1 |
13786 |
2.0 |
0.0 |
0.650 |
0 |
0 |
0 |
0.000 |
Average: |
5.2 |
-0.1 |
0.557 |
0 |
0 |
0 |
0.000 |
28 |
68 |
|
L |
1 |
1 |
13967 |
◊ |
H |
x-1,y,z |
1_455 |
3 |
1 |
13786 |
7.2 |
-0.2 |
0.406 |
0 |
0 |
0 |
0.000 |
29 |
69 |
|
P |
2 |
1 |
11726 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
12438 |
3.0 |
0.1 |
0.732 |
0 |
0 |
0 |
0.000 |
30 |
70 |
|
U |
2 |
1 |
6929 |
◊ |
D |
x,y-1,z |
1_545 |
2 |
1 |
7154 |
2.4 |
0.1 |
0.661 |
0 |
0 |
0 |
0.000 |
31 |
71 |
|
Q |
1 |
1 |
13969 |
◊ |
J |
x-1,y+1,z-1 |
1_464 |
1 |
1 |
6635 |
1.3 |
-0.0 |
0.503 |
0 |
0 |
0 |
0.000 |
|