## |
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 |
|
F |
150 |
42 |
17987 |
◊ |
D |
x,y,z |
1_555 |
152 |
41 |
18147 |
1447.3 |
2.8 |
0.811 |
37 |
24 |
0 |
0.410 |
2 |
|
E |
147 |
40 |
18304 |
◊ |
B |
x,y,z |
1_555 |
153 |
41 |
18018 |
1436.2 |
1.6 |
0.754 |
33 |
24 |
0 |
0.410 |
3 |
|
J |
151 |
41 |
19395 |
◊ |
H |
x,y,z |
1_555 |
143 |
41 |
17877 |
1419.3 |
1.9 |
0.790 |
36 |
24 |
0 |
0.410 |
Average: |
1434.3 |
2.1 |
0.785 |
35 |
24 |
0 |
0.410 |
2 |
4 |
|
L |
150 |
42 |
19378 |
◊ |
A |
x,y,z |
1_555 |
152 |
44 |
18268 |
1444.0 |
1.3 |
0.737 |
37 |
24 |
0 |
0.563 |
5 |
|
I |
146 |
40 |
19261 |
◊ |
C |
x,y,z |
1_555 |
149 |
41 |
17917 |
1438.2 |
1.0 |
0.736 |
33 |
24 |
0 |
0.563 |
Average: |
1441.1 |
1.2 |
0.737 |
35 |
24 |
0 |
0.563 |
3 |
6 |
|
K |
143 |
40 |
14226 |
◊ |
G |
x,y,z |
1_555 |
149 |
40 |
18170 |
1424.5 |
0.9 |
0.814 |
35 |
24 |
0 |
0.576 |
4 |
7 |
|
L |
127 |
32 |
19378 |
◊ |
J |
x,y,z |
1_555 |
117 |
26 |
19395 |
1085.0 |
-2.3 |
0.475 |
14 |
1 |
0 |
0.111 |
8 |
|
I |
123 |
32 |
19261 |
◊ |
F |
x,y,z |
1_555 |
117 |
26 |
17987 |
1059.6 |
-3.8 |
0.380 |
12 |
0 |
0 |
0.111 |
Average: |
1072.3 |
-3.0 |
0.427 |
13 |
1 |
0 |
0.111 |
5 |
9 |
|
K |
118 |
27 |
14226 |
◊ |
J |
x,y,z |
1_555 |
121 |
31 |
19395 |
1061.5 |
-2.9 |
0.461 |
12 |
0 |
0 |
0.143 |
6 |
10 |
|
K |
123 |
33 |
14226 |
◊ |
L |
x,y,z |
1_555 |
112 |
27 |
19378 |
1057.7 |
-4.5 |
0.528 |
12 |
0 |
0 |
0.126 |
7 |
11 |
|
C |
120 |
33 |
17917 |
◊ |
B |
x,y,z |
1_555 |
113 |
27 |
18018 |
1050.8 |
-3.7 |
0.362 |
14 |
0 |
0 |
0.307 |
12 |
|
D |
123 |
32 |
18147 |
◊ |
C |
x,y,z |
1_555 |
111 |
27 |
17917 |
1050.2 |
-3.3 |
0.386 |
14 |
0 |
0 |
0.307 |
13 |
|
F |
121 |
33 |
17987 |
◊ |
E |
x,y,z |
1_555 |
114 |
28 |
18304 |
1046.6 |
-3.1 |
0.405 |
15 |
0 |
0 |
0.307 |
14 |
|
H |
116 |
27 |
17877 |
◊ |
G |
x,y,z |
1_555 |
119 |
32 |
18170 |
1045.7 |
-4.5 |
0.350 |
13 |
0 |
0 |
0.307 |
15 |
|
H |
122 |
33 |
17877 |
◊ |
A |
x,y,z |
1_555 |
109 |
27 |
18268 |
1043.1 |
-4.2 |
0.387 |
13 |
0 |
0 |
0.307 |
16 |
|
D |
115 |
27 |
18147 |
◊ |
B |
x,y,z |
1_555 |
122 |
32 |
18018 |
1039.4 |
-3.1 |
0.389 |
14 |
0 |
0 |
0.307 |
17 |
|
G |
114 |
27 |
18170 |
◊ |
A |
x,y,z |
1_555 |
119 |
31 |
18268 |
1031.7 |
-2.8 |
0.387 |
13 |
0 |
0 |
0.307 |
Average: |
1043.9 |
-3.5 |
0.381 |
14 |
0 |
0 |
0.307 |
8 |
18 |
|
I |
111 |
27 |
19261 |
◊ |
E |
x,y,z |
1_555 |
121 |
32 |
18304 |
1049.9 |
-2.9 |
0.402 |
12 |
0 |
0 |
0.138 |
9 |
19 |
|
[NAP]J:501 |
48 |
1 |
927 |
f |
J |
x,y,z |
1_555 |
84 |
35 |
19395 |
643.2 |
-5.6 |
0.390 |
14 |
0 |
0 |
0.553 |
20 |
|
[NAP]H:501 |
47 |
1 |
894 |
f |
H |
x,y,z |
1_555 |
77 |
32 |
17877 |
620.3 |
-4.5 |
0.479 |
17 |
0 |
0 |
0.553 |
21 |
|
[NAP]D:501 |
47 |
1 |
897 |
f |
D |
x,y,z |
1_555 |
80 |
32 |
18147 |
620.0 |
-3.7 |
0.511 |
15 |
0 |
0 |
0.553 |
Average: |
627.8 |
-4.6 |
0.460 |
15 |
0 |
0 |
0.553 |
10 |
22 |
|
[NAP]E:501 |
47 |
1 |
890 |
f |
E |
x,y,z |
1_555 |
83 |
32 |
18304 |
626.2 |
-4.2 |
0.485 |
18 |
0 |
0 |
0.571 |
23 |
|
[NAP]B:501 |
46 |
1 |
887 |
f |
B |
x,y,z |
1_555 |
77 |
30 |
18018 |
625.8 |
-5.0 |
0.488 |
18 |
0 |
0 |
0.571 |
24 |
|
[NAP]C:501 |
46 |
1 |
891 |
f |
C |
x,y,z |
1_555 |
82 |
33 |
17917 |
623.8 |
-5.4 |
0.474 |
16 |
0 |
0 |
0.571 |
25 |
|
[NAP]A:501 |
46 |
1 |
883 |
f |
A |
x,y,z |
1_555 |
86 |
35 |
18268 |
623.5 |
-5.4 |
0.489 |
18 |
0 |
0 |
0.571 |
26 |
|
[NAP]G:501 |
47 |
1 |
885 |
f |
G |
x,y,z |
1_555 |
79 |
31 |
18170 |
622.8 |
-5.7 |
0.457 |
17 |
0 |
0 |
0.571 |
27 |
|
[NAP]F:501 |
48 |
1 |
879 |
f |
F |
x,y,z |
1_555 |
79 |
32 |
17987 |
616.3 |
-4.9 |
0.500 |
17 |
0 |
0 |
0.571 |
Average: |
623.1 |
-5.1 |
0.482 |
17 |
0 |
0 |
0.571 |
11 |
28 |
|
L |
52 |
19 |
19378 |
◊ |
G |
x,y,z |
1_555 |
50 |
20 |
18170 |
538.8 |
-3.3 |
0.329 |
9 |
0 |
0 |
0.125 |
29 |
|
I |
52 |
19 |
19261 |
◊ |
B |
x,y,z |
1_555 |
52 |
19 |
18018 |
529.7 |
-3.5 |
0.302 |
9 |
0 |
0 |
0.125 |
Average: |
534.3 |
-3.4 |
0.316 |
9 |
0 |
0 |
0.125 |
12 |
30 |
|
F |
52 |
19 |
17987 |
◊ |
C |
x,y,z |
1_555 |
53 |
19 |
17917 |
535.5 |
-3.1 |
0.361 |
7 |
0 |
0 |
0.089 |
31 |
|
E |
51 |
19 |
18304 |
◊ |
D |
x,y,z |
1_555 |
53 |
19 |
18147 |
535.4 |
-3.9 |
0.270 |
8 |
0 |
0 |
0.089 |
32 |
|
J |
51 |
19 |
19395 |
◊ |
A |
x,y,z |
1_555 |
53 |
19 |
18268 |
534.2 |
-1.5 |
0.467 |
7 |
0 |
0 |
0.089 |
Average: |
535.0 |
-2.8 |
0.366 |
7 |
0 |
0 |
0.089 |
13 |
33 |
|
K |
52 |
19 |
14226 |
◊ |
H |
x,y,z |
1_555 |
50 |
19 |
17877 |
531.3 |
-2.2 |
0.515 |
9 |
0 |
0 |
0.107 |
14 |
34 |
|
E |
60 |
20 |
18304 |
◊ |
L |
-x+1,y-1/2,-z |
2_645 |
55 |
19 |
19378 |
507.9 |
3.2 |
0.823 |
9 |
5 |
0 |
0.000 |
15 |
35 |
|
F |
58 |
21 |
17987 |
◊ |
I |
-x,y-1/2,-z-1 |
2_544 |
60 |
18 |
19261 |
505.9 |
-0.8 |
0.526 |
3 |
0 |
0 |
0.000 |
16 |
36 |
|
B |
37 |
13 |
18018 |
◊ |
A |
x,y,z |
1_555 |
36 |
13 |
18268 |
330.2 |
3.6 |
0.886 |
6 |
7 |
0 |
0.000 |
17 |
37 |
|
G |
38 |
13 |
18170 |
◊ |
C |
x,y,z |
1_555 |
33 |
14 |
17917 |
295.9 |
0.1 |
0.640 |
3 |
0 |
0 |
0.000 |
38 |
|
H |
29 |
13 |
17877 |
◊ |
D |
x,y,z |
1_555 |
33 |
11 |
18147 |
276.6 |
0.9 |
0.705 |
4 |
0 |
0 |
0.000 |
Average: |
286.3 |
0.5 |
0.672 |
4 |
0 |
0 |
0.000 |
18 |
39 |
|
D |
40 |
14 |
18147 |
◊ |
C |
x,y-1,z |
1_545 |
35 |
11 |
17917 |
280.3 |
-0.1 |
0.611 |
1 |
1 |
0 |
0.000 |
19 |
40 |
|
A |
32 |
8 |
18268 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
29 |
10 |
18018 |
278.2 |
0.2 |
0.473 |
4 |
0 |
0 |
0.000 |
20 |
41 |
|
H |
22 |
9 |
17877 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
21 |
8 |
17917 |
198.6 |
0.7 |
0.714 |
2 |
2 |
0 |
0.001 |
21 |
42 |
|
A |
14 |
4 |
18268 |
◊ |
G |
x,y-1,z |
1_545 |
21 |
8 |
18170 |
172.3 |
-0.1 |
0.596 |
1 |
0 |
0 |
0.000 |
22 |
43 |
|
[AKG]G:502 |
10 |
1 |
282 |
f |
G |
x,y,z |
1_555 |
28 |
15 |
18170 |
154.7 |
2.1 |
0.598 |
6 |
0 |
0 |
0.044 |
44 |
|
[AKG]E:502 |
10 |
1 |
281 |
f |
E |
x,y,z |
1_555 |
25 |
15 |
18304 |
152.8 |
2.2 |
0.601 |
7 |
0 |
0 |
0.044 |
45 |
|
[AKG]H:502 |
10 |
1 |
282 |
f |
H |
x,y,z |
1_555 |
26 |
15 |
17877 |
152.7 |
2.0 |
0.602 |
8 |
0 |
0 |
0.044 |
46 |
|
[AKG]F:502 |
10 |
1 |
280 |
f |
F |
x,y,z |
1_555 |
24 |
15 |
17987 |
152.2 |
2.0 |
0.601 |
8 |
0 |
0 |
0.044 |
47 |
|
[AKG]A:502 |
10 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
25 |
15 |
18268 |
149.1 |
2.1 |
0.598 |
8 |
0 |
0 |
0.044 |
Average: |
152.3 |
2.1 |
0.600 |
7 |
0 |
0 |
0.044 |
23 |
48 |
|
[AKG]D:502 |
10 |
1 |
286 |
f |
D |
x,y,z |
1_555 |
27 |
15 |
18147 |
153.1 |
2.0 |
0.614 |
8 |
0 |
0 |
0.036 |
24 |
49 |
|
[AKG]C:502 |
10 |
1 |
284 |
f |
C |
x,y,z |
1_555 |
25 |
15 |
17917 |
152.1 |
2.0 |
0.602 |
8 |
0 |
0 |
0.049 |
25 |
50 |
|
[AKG]J:502 |
10 |
1 |
280 |
f |
J |
x,y,z |
1_555 |
27 |
14 |
19395 |
151.4 |
1.0 |
0.513 |
3 |
0 |
0 |
0.008 |
26 |
51 |
|
[AKG]B:502 |
10 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
22 |
15 |
18018 |
149.7 |
2.1 |
0.599 |
9 |
0 |
0 |
0.043 |
27 |
52 |
|
F |
13 |
4 |
17987 |
◊ |
J |
-x,y-1/2,-z |
2_545 |
16 |
8 |
19395 |
122.1 |
2.0 |
0.825 |
3 |
4 |
0 |
0.000 |
28 |
53 |
|
I |
14 |
6 |
19261 |
◊ |
K |
x,y,z-1 |
1_554 |
11 |
3 |
14226 |
113.3 |
1.2 |
0.800 |
1 |
0 |
0 |
0.000 |
29 |
54 |
|
L |
12 |
6 |
19378 |
x |
L |
-x+1,y-1/2,-z+1 |
2_646 |
11 |
3 |
19378 |
99.1 |
0.3 |
0.647 |
1 |
0 |
0 |
0.000 |
30 |
55 |
|
H |
11 |
5 |
17877 |
◊ |
G |
-x,y-1/2,-z |
2_545 |
13 |
6 |
18170 |
89.2 |
-0.5 |
0.344 |
0 |
0 |
0 |
0.000 |
31 |
56 |
|
I |
12 |
5 |
19261 |
◊ |
J |
x,y,z-1 |
1_554 |
9 |
5 |
19395 |
69.7 |
1.6 |
0.836 |
0 |
0 |
0 |
0.000 |
32 |
57 |
|
J |
6 |
3 |
19395 |
◊ |
I |
-x,y-1/2,-z |
2_545 |
4 |
1 |
19261 |
69.5 |
-0.7 |
0.104 |
0 |
0 |
0 |
0.002 |
33 |
58 |
|
[AKG]J:502 |
7 |
1 |
280 |
f |
[NAP]J:501 |
x,y,z |
1_555 |
11 |
1 |
927 |
62.6 |
0.1 |
0.458 |
0 |
0 |
0 |
0.000 |
34 |
59 |
|
[AKG]D:502 |
7 |
1 |
286 |
f |
[NAP]D:501 |
x,y,z |
1_555 |
9 |
1 |
897 |
59.4 |
-0.1 |
0.432 |
0 |
0 |
0 |
0.003 |
35 |
60 |
|
F |
7 |
4 |
17987 |
◊ |
C |
x,y-1,z |
1_545 |
13 |
6 |
17917 |
55.7 |
-1.3 |
0.229 |
0 |
0 |
0 |
0.000 |
36 |
61 |
|
[AKG]A:502 |
7 |
1 |
281 |
f |
[NAP]A:501 |
x,y,z |
1_555 |
9 |
1 |
883 |
53.8 |
0.3 |
0.488 |
0 |
0 |
0 |
0.000 |
62 |
|
[AKG]H:502 |
7 |
1 |
282 |
f |
[NAP]H:501 |
x,y,z |
1_555 |
8 |
1 |
894 |
52.1 |
0.2 |
0.444 |
0 |
0 |
0 |
0.000 |
63 |
|
[AKG]F:502 |
7 |
1 |
280 |
f |
[NAP]F:501 |
x,y,z |
1_555 |
9 |
1 |
879 |
51.8 |
0.3 |
0.484 |
0 |
0 |
0 |
0.000 |
64 |
|
[AKG]G:502 |
7 |
1 |
282 |
f |
[NAP]G:501 |
x,y,z |
1_555 |
8 |
1 |
885 |
51.4 |
0.4 |
0.488 |
0 |
0 |
0 |
0.000 |
65 |
|
[AKG]E:502 |
6 |
1 |
281 |
f |
[NAP]E:501 |
x,y,z |
1_555 |
8 |
1 |
890 |
49.9 |
0.3 |
0.476 |
0 |
0 |
0 |
0.000 |
Average: |
51.8 |
0.3 |
0.476 |
0 |
0 |
0 |
0.000 |
37 |
66 |
|
[AKG]C:502 |
7 |
1 |
284 |
f |
[NAP]C:501 |
x,y,z |
1_555 |
8 |
1 |
891 |
53.2 |
0.3 |
0.477 |
0 |
0 |
0 |
0.000 |
38 |
67 |
|
J |
3 |
1 |
19395 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
5 |
3 |
17917 |
49.7 |
0.6 |
0.803 |
0 |
2 |
0 |
0.000 |
39 |
68 |
|
[AKG]B:502 |
6 |
1 |
281 |
f |
[NAP]B:501 |
x,y,z |
1_555 |
8 |
1 |
887 |
49.1 |
0.2 |
0.479 |
0 |
0 |
0 |
0.000 |
40 |
69 |
|
B |
5 |
2 |
18018 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
18018 |
41.0 |
0.9 |
0.823 |
0 |
1 |
0 |
0.000 |
41 |
70 |
|
[NAP]H:501 |
6 |
1 |
894 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
4 |
1 |
17917 |
37.1 |
-0.0 |
0.364 |
0 |
0 |
0 |
0.000 |
42 |
71 |
|
D |
5 |
2 |
18147 |
◊ |
G |
x,y-1,z |
1_545 |
4 |
2 |
18170 |
32.1 |
-0.2 |
0.421 |
0 |
0 |
0 |
0.000 |
43 |
72 |
|
F |
3 |
2 |
17987 |
◊ |
J |
x,y,z-1 |
1_554 |
4 |
2 |
19395 |
20.3 |
-0.3 |
0.389 |
0 |
0 |
0 |
0.000 |
44 |
73 |
|
H |
2 |
1 |
17877 |
◊ |
G |
x,y-1,z |
1_545 |
1 |
1 |
18170 |
12.6 |
0.3 |
0.509 |
0 |
0 |
0 |
0.000 |
|