Deposited unit | A: Acetyl-xylan esterase Est2A B: Acetyl-xylan esterase Est2A C: Acetyl-xylan esterase Est2A D: Acetyl-xylan esterase Est2A E: Acetyl-xylan esterase Est2A F: Acetyl-xylan esterase Est2A G: Acetyl-xylan esterase Est2A H: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 370,763 | 19 |
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Polymers | 370,071 | 8 |
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Non-polymers | 693 | 11 |
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Water | 20,537 | 1140 |
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1 | A: Acetyl-xylan esterase Est2A B: Acetyl-xylan esterase Est2A C: Acetyl-xylan esterase Est2A D: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 185,368 | 9 |
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Polymers | 185,035 | 4 |
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Non-polymers | 332 | 5 |
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Water | 72 | 4 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
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2 | E: Acetyl-xylan esterase Est2A F: Acetyl-xylan esterase Est2A G: Acetyl-xylan esterase Est2A H: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 185,396 | 10 |
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Polymers | 185,035 | 4 |
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Non-polymers | 360 | 6 |
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Water | 72 | 4 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
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3 | A: Acetyl-xylan esterase Est2A C: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 92,638 | 4 |
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Polymers | 92,518 | 2 |
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Non-polymers | 120 | 2 |
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Water | 36 | 2 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 2490 Å2 |
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ΔGint | -15 kcal/mol |
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Surface area | 28620 Å2 |
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Method | PISA |
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4 | B: Acetyl-xylan esterase Est2A D: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 92,730 | 5 |
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Polymers | 92,518 | 2 |
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Non-polymers | 212 | 3 |
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Water | 36 | 2 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 2710 Å2 |
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ΔGint | -15 kcal/mol |
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Surface area | 28680 Å2 |
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Method | PISA |
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5 | E: Acetyl-xylan esterase Est2A G: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 92,638 | 4 |
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Polymers | 92,518 | 2 |
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Non-polymers | 120 | 2 |
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Water | 36 | 2 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 2510 Å2 |
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ΔGint | -15 kcal/mol |
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Surface area | 28390 Å2 |
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Method | PISA |
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6 | F: Acetyl-xylan esterase Est2A H: Acetyl-xylan esterase Est2A hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 92,758 | 6 |
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Polymers | 92,518 | 2 |
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Non-polymers | 240 | 4 |
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Water | 36 | 2 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 2480 Å2 |
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ΔGint | -15 kcal/mol |
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Surface area | 28380 Å2 |
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Method | PISA |
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Unit cell | Length a, b, c (Å) | 96.128, 90.282, 99.175 |
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Angle α, β, γ (deg.) | 99.80, 90.21, 92.56 |
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Int Tables number | 1 |
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Space group name H-M | P1 |
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Noncrystallographic symmetry (NCS) | NCS domain: ID | Ens-ID | Details |
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1 | 1 | A2 | 1 | B1 | 2 | A2 | 2 | C1 | 3 | A2 | 3 | D1 | 4 | A2 | 4 | E1 | 5 | A2 | 5 | F1 | 6 | A2 | 6 | G1 | 7 | A2 | 7 | H1 | 8 | B2 | 8 | C1 | 9 | B2 | 9 | D1 | 10 | B2 | 10 | E1 | 11 | B2 | 11 | F1 | 12 | B2 | 12 | G1 | 13 | B2 | 13 | H1 | 14 | C2 | 14 | D1 | 15 | C2 | 15 | E1 | 16 | C2 | 16 | F1 | 17 | C2 | 17 | G1 | 18 | C2 | 18 | H1 | 19 | D2 | 19 | E1 | 20 | D2 | 20 | F1 | 21 | D2 | 21 | G1 | 22 | D2 | 22 | H1 | 23 | E2 | 23 | F1 | 24 | E2 | 24 | G1 | 25 | E2 | 25 | H1 | 26 | F2 | 26 | G1 | 27 | F2 | 27 | H1 | 28 | G2 | 28 | H | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | |
NCS domain segments: Component-ID: _ / Beg auth comp-ID: VAL / Beg label comp-ID: VAL / Refine code: _ Dom-ID | Ens-ID | End auth comp-ID | End label comp-ID | Auth asym-ID | Label asym-ID | Auth seq-ID | Label seq-ID |
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1 | 1 | TRPTRPAA3 - 374 | 35 - 406 | 2 | 1 | TRPTRPBB3 - 374 | 35 - 406 | 1 | 2 | TRPTRPAA3 - 374 | 35 - 406 | 2 | 2 | TRPTRPCC3 - 374 | 35 - 406 | 1 | 3 | TRPTRPAA3 - 374 | 35 - 406 | 2 | 3 | TRPTRPDD3 - 374 | 35 - 406 | 1 | 4 | PHEPHEAA3 - 375 | 35 - 407 | 2 | 4 | PHEPHEEE3 - 375 | 35 - 407 | 1 | 5 | PHEPHEAA3 - 375 | 35 - 407 | 2 | 5 | PHEPHEFF3 - 375 | 35 - 407 | 1 | 6 | TRPTRPAA3 - 374 | 35 - 406 | 2 | 6 | TRPTRPGG3 - 374 | 35 - 406 | 1 | 7 | TRPTRPAA3 - 374 | 35 - 406 | 2 | 7 | TRPTRPHH3 - 374 | 35 - 406 | 1 | 8 | GLUGLUBB3 - 376 | 35 - 408 | 2 | 8 | GLUGLUCC3 - 376 | 35 - 408 | 1 | 9 | GLUGLUBB3 - 376 | 35 - 408 | 2 | 9 | GLUGLUDD3 - 376 | 35 - 408 | 1 | 10 | TRPTRPBB | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | | |
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