## |
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 |
61 |
18 |
7104 |
◊ |
F |
x,y,z |
1_555 |
64 |
19 |
6974 |
558.3 |
-6.4 |
0.411 |
3 |
0 |
0 |
0.213 |
2 |
|
E |
63 |
20 |
6915 |
◊ |
C |
x,y,z |
1_555 |
62 |
18 |
7278 |
540.2 |
-6.8 |
0.386 |
3 |
0 |
0 |
0.213 |
3 |
|
D |
59 |
18 |
7111 |
◊ |
B |
x,y,z |
1_555 |
62 |
17 |
6833 |
532.8 |
-7.1 |
0.326 |
3 |
0 |
0 |
0.213 |
4 |
|
G |
60 |
18 |
6996 |
◊ |
A |
x,y,z |
1_555 |
59 |
18 |
6705 |
528.1 |
-6.9 |
0.364 |
3 |
0 |
0 |
0.213 |
Average: |
539.8 |
-6.8 |
0.372 |
3 |
0 |
0 |
0.213 |
2 |
5 |
|
H |
46 |
16 |
7104 |
◊ |
C |
x,y,z |
1_555 |
47 |
16 |
7278 |
471.8 |
-4.1 |
0.532 |
0 |
0 |
0 |
0.133 |
6 |
|
G |
51 |
16 |
6996 |
◊ |
D |
x,y,z |
1_555 |
50 |
16 |
7111 |
464.8 |
-3.4 |
0.604 |
0 |
0 |
0 |
0.133 |
Average: |
468.3 |
-3.8 |
0.568 |
0 |
0 |
0 |
0.133 |
3 |
7 |
|
F |
45 |
14 |
6974 |
◊ |
E |
x-1,y,z |
1_455 |
44 |
13 |
6915 |
419.4 |
-2.5 |
0.639 |
4 |
0 |
0 |
0.000 |
4 |
8 |
|
I |
44 |
14 |
6713 |
◊ |
E |
x,y,z |
1_555 |
42 |
13 |
6915 |
408.1 |
-6.6 |
0.219 |
0 |
0 |
0 |
0.091 |
9 |
|
J |
43 |
15 |
6414 |
◊ |
F |
x,y,z |
1_555 |
40 |
13 |
6974 |
407.4 |
-5.2 |
0.281 |
0 |
0 |
0 |
0.091 |
Average: |
407.7 |
-5.9 |
0.250 |
0 |
0 |
0 |
0.091 |
5 |
10 |
|
H |
33 |
11 |
7104 |
◊ |
A |
x,y,z |
1_555 |
28 |
11 |
6705 |
335.1 |
-9.8 |
0.022 |
0 |
0 |
0 |
0.251 |
11 |
|
E |
31 |
11 |
6915 |
◊ |
D |
x,y,z |
1_555 |
31 |
11 |
7111 |
329.3 |
-9.4 |
0.026 |
0 |
0 |
0 |
0.251 |
12 |
|
C |
32 |
11 |
7278 |
◊ |
B |
x,y,z |
1_555 |
28 |
11 |
6833 |
327.2 |
-9.6 |
0.021 |
0 |
0 |
0 |
0.251 |
13 |
|
G |
33 |
11 |
6996 |
◊ |
F |
x,y,z |
1_555 |
30 |
12 |
6974 |
310.4 |
-9.0 |
0.028 |
0 |
0 |
0 |
0.251 |
Average: |
325.5 |
-9.5 |
0.024 |
0 |
0 |
0 |
0.251 |
6 |
14 |
|
F |
38 |
12 |
6974 |
◊ |
C |
x,y,z |
1_555 |
35 |
10 |
7278 |
331.3 |
-4.4 |
0.394 |
3 |
0 |
0 |
0.115 |
15 |
|
G |
34 |
10 |
6996 |
◊ |
B |
x,y,z |
1_555 |
38 |
12 |
6833 |
328.2 |
-4.2 |
0.417 |
3 |
0 |
0 |
0.115 |
16 |
|
H |
34 |
10 |
7104 |
◊ |
E |
x,y,z |
1_555 |
38 |
12 |
6915 |
322.0 |
-4.3 |
0.404 |
3 |
0 |
0 |
0.115 |
17 |
|
D |
35 |
10 |
7111 |
◊ |
A |
x,y,z |
1_555 |
33 |
11 |
6705 |
307.2 |
-4.5 |
0.381 |
3 |
0 |
0 |
0.115 |
Average: |
322.2 |
-4.4 |
0.399 |
3 |
0 |
0 |
0.115 |
7 |
18 |
|
I |
42 |
14 |
6713 |
◊ |
B |
x,y,z |
1_555 |
33 |
12 |
6833 |
325.3 |
-5.7 |
0.222 |
1 |
0 |
0 |
0.062 |
19 |
|
J |
36 |
13 |
6414 |
◊ |
A |
x,y,z |
1_555 |
33 |
12 |
6705 |
320.9 |
-5.4 |
0.182 |
1 |
0 |
0 |
0.062 |
Average: |
323.1 |
-5.5 |
0.202 |
1 |
0 |
0 |
0.062 |
8 |
20 |
|
J |
39 |
10 |
6414 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
31 |
7 |
7278 |
324.7 |
-1.2 |
0.650 |
0 |
0 |
0 |
0.000 |
9 |
21 |
|
D |
32 |
9 |
7111 |
◊ |
I |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
9 |
6713 |
283.0 |
-2.5 |
0.450 |
1 |
0 |
0 |
0.000 |
10 |
22 |
|
I |
24 |
9 |
6713 |
◊ |
D |
x,y,z |
1_555 |
26 |
10 |
7111 |
261.0 |
-5.2 |
0.137 |
0 |
0 |
0 |
0.066 |
23 |
|
J |
21 |
8 |
6414 |
◊ |
G |
x,y,z |
1_555 |
20 |
9 |
6996 |
216.1 |
-6.2 |
0.043 |
0 |
0 |
0 |
0.066 |
Average: |
238.5 |
-5.7 |
0.090 |
0 |
0 |
0 |
0.066 |
11 |
24 |
|
G |
24 |
6 |
6996 |
◊ |
C |
x,y-1,z |
1_545 |
27 |
10 |
7278 |
222.9 |
-2.0 |
0.470 |
0 |
0 |
0 |
0.000 |
12 |
25 |
|
D |
25 |
4 |
7111 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
23 |
4 |
6833 |
220.6 |
-2.7 |
0.451 |
0 |
0 |
0 |
0.000 |
13 |
26 |
|
B |
17 |
8 |
6833 |
◊ |
E |
x-1,y,z |
1_455 |
22 |
8 |
6915 |
189.6 |
-3.1 |
0.333 |
0 |
0 |
0 |
0.000 |
27 |
|
F |
22 |
8 |
6974 |
◊ |
A |
x-1,y,z |
1_455 |
20 |
8 |
6705 |
184.2 |
-2.8 |
0.414 |
0 |
0 |
0 |
0.000 |
Average: |
186.9 |
-2.9 |
0.373 |
0 |
0 |
0 |
0.000 |
14 |
28 |
|
F |
14 |
5 |
6974 |
◊ |
H |
x-1,y,z |
1_455 |
17 |
5 |
7104 |
149.8 |
-0.5 |
0.644 |
2 |
0 |
0 |
0.000 |
29 |
|
C |
18 |
5 |
7278 |
◊ |
E |
x-1,y,z |
1_455 |
14 |
5 |
6915 |
144.2 |
-0.2 |
0.681 |
1 |
0 |
0 |
0.000 |
Average: |
147.0 |
-0.4 |
0.662 |
2 |
0 |
0 |
0.000 |
15 |
30 |
|
H |
13 |
2 |
7104 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
16 |
3 |
6705 |
122.1 |
-0.7 |
0.646 |
0 |
0 |
0 |
0.000 |
16 |
31 |
|
J |
16 |
6 |
6414 |
◊ |
G |
x-1/2,-y-1/2,-z+1 |
4_446 |
13 |
3 |
6996 |
121.3 |
-1.2 |
0.511 |
0 |
0 |
0 |
0.000 |
17 |
32 |
|
[GOL]F:1174 |
6 |
1 |
222 |
f |
F |
x,y,z |
1_555 |
16 |
9 |
6974 |
105.2 |
-0.7 |
0.518 |
2 |
0 |
0 |
0.021 |
18 |
33 |
|
[GOL]F:1173 |
6 |
1 |
216 |
f |
F |
x,y,z |
1_555 |
17 |
6 |
6974 |
103.1 |
-0.3 |
0.625 |
2 |
0 |
0 |
0.016 |
19 |
34 |
|
[GOL]E:1173 |
6 |
1 |
219 |
f |
E |
x,y,z |
1_555 |
17 |
6 |
6915 |
103.0 |
-0.5 |
0.527 |
4 |
0 |
0 |
0.028 |
20 |
35 |
|
[GOL]A:1171 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
6705 |
102.5 |
-0.4 |
0.612 |
1 |
0 |
0 |
0.011 |
36 |
|
[GOL]B:1172 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
6833 |
102.3 |
-0.4 |
0.603 |
1 |
0 |
0 |
0.011 |
Average: |
102.4 |
-0.4 |
0.607 |
1 |
0 |
0 |
0.011 |
21 |
37 |
|
E |
8 |
3 |
6915 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
6705 |
80.1 |
-2.5 |
0.105 |
0 |
0 |
0 |
0.024 |
38 |
|
F |
6 |
3 |
6974 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
6833 |
78.7 |
-2.5 |
0.100 |
0 |
0 |
0 |
0.024 |
Average: |
79.4 |
-2.5 |
0.102 |
0 |
0 |
0 |
0.024 |
22 |
39 |
|
[GOL]F:1174 |
5 |
1 |
222 |
◊ |
G |
x,y,z |
1_555 |
12 |
3 |
6996 |
74.3 |
-0.8 |
0.482 |
0 |
0 |
0 |
0.010 |
23 |
40 |
|
[CL]B:1173 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
9 |
6833 |
69.2 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.335 |
41 |
|
[CL]A:1172 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
6705 |
68.0 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.335 |
42 |
|
[CL]E:1174 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
14 |
9 |
6915 |
67.3 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.335 |
43 |
|
[CL]F:1175 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
11 |
7 |
6974 |
67.1 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.335 |
Average: |
67.9 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.335 |
24 |
44 |
|
I |
9 |
3 |
6713 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
7278 |
68.5 |
-1.6 |
0.186 |
0 |
0 |
0 |
0.025 |
45 |
|
J |
7 |
2 |
6414 |
◊ |
H |
x,y,z |
1_555 |
4 |
2 |
7104 |
65.4 |
-1.6 |
0.139 |
0 |
0 |
0 |
0.025 |
Average: |
67.0 |
-1.6 |
0.162 |
0 |
0 |
0 |
0.025 |
25 |
46 |
|
[GOL]E:1173 |
4 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
11 |
6 |
7278 |
67.1 |
-0.3 |
0.528 |
1 |
0 |
0 |
0.009 |
26 |
47 |
|
[GOL]B:1172 |
4 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
11 |
6 |
7111 |
66.6 |
-0.3 |
0.611 |
1 |
0 |
0 |
0.010 |
48 |
|
[GOL]A:1171 |
4 |
1 |
217 |
◊ |
G |
x,y,z |
1_555 |
11 |
5 |
6996 |
66.4 |
-0.3 |
0.581 |
1 |
0 |
0 |
0.010 |
Average: |
66.5 |
-0.3 |
0.596 |
1 |
0 |
0 |
0.010 |
27 |
49 |
|
[GOL]F:1173 |
4 |
1 |
216 |
◊ |
H |
x,y,z |
1_555 |
11 |
6 |
7104 |
66.4 |
-0.4 |
0.596 |
1 |
0 |
0 |
0.011 |
28 |
50 |
|
[CL]E:1175 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
10 |
4 |
6915 |
61.7 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.108 |
29 |
51 |
|
[CL]H:1171 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
11 |
4 |
7104 |
59.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.253 |
30 |
52 |
|
[CL]C:1173 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
7278 |
59.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.186 |
31 |
53 |
|
[CL]C:1174 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
7278 |
56.0 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.427 |
54 |
|
[CL]C:1174 |
1 |
1 |
125 |
◊ |
H |
x,y,z |
1_555 |
8 |
5 |
7104 |
52.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.427 |
Average: |
54.2 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.427 |
32 |
55 |
|
[CL]I:1171 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
7 |
2 |
6713 |
54.9 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.055 |
33 |
56 |
|
[GOL]J:1171 |
5 |
1 |
219 |
◊ |
G |
x,y,z |
1_555 |
10 |
3 |
6996 |
54.7 |
0.6 |
0.775 |
0 |
0 |
0 |
0.000 |
34 |
57 |
|
[CL]I:1172 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
11 |
6 |
6713 |
49.9 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.056 |
35 |
58 |
|
D |
8 |
4 |
7111 |
◊ |
[CL]I:1172 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
125 |
49.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
59 |
|
[GOL]J:1171 |
3 |
1 |
219 |
f |
J |
x,y,z |
1_555 |
4 |
1 |
6414 |
43.0 |
-0.7 |
0.423 |
0 |
0 |
0 |
0.100 |
37 |
60 |
|
E |
6 |
4 |
6915 |
◊ |
B |
x,y,z |
1_555 |
5 |
4 |
6833 |
39.5 |
-1.3 |
0.234 |
0 |
0 |
0 |
0.017 |
61 |
|
F |
5 |
4 |
6974 |
◊ |
A |
x,y,z |
1_555 |
5 |
4 |
6705 |
38.7 |
-1.2 |
0.219 |
0 |
0 |
0 |
0.017 |
Average: |
39.1 |
-1.3 |
0.226 |
0 |
0 |
0 |
0.017 |
38 |
62 |
|
[CL]I:1171 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
6915 |
29.3 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.022 |
39 |
63 |
|
J |
4 |
1 |
6414 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
7104 |
22.1 |
0.2 |
0.715 |
0 |
0 |
0 |
0.000 |
40 |
64 |
|
J |
3 |
1 |
6414 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
4 |
3 |
6705 |
20.9 |
0.1 |
0.645 |
0 |
0 |
0 |
0.000 |
41 |
65 |
|
I |
1 |
1 |
6713 |
◊ |
J |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
6414 |
8.1 |
0.6 |
0.927 |
0 |
0 |
0 |
0.000 |
42 |
66 |
|
G |
1 |
1 |
6996 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
1 |
1 |
6705 |
0.4 |
-0.0 |
0.642 |
0 |
0 |
0 |
0.000 |
|