Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b4f12c54b0386b983b16c8c5f788bccc",
"space_group_name": "P 1",
"unit_cell": {
"a": 44.76,
"b": 63.61,
"c": 88.14,
"alpha": 101.12,
"beta": 97.60,
"gamma": 112.00
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100,2.100],
"number_observations_unique": 49428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 98.200
}
]
},
"refln_shells": [
{
"resolution_limits": [2.20,2.10],
"number_observations": 25191,
"number_observations_unique": 6370,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.477
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 97.30
}
]
},
{
"resolution_limits": [2.30,2.20],
"number_observations": 20970,
"number_observations_unique": 5301,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.381
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 97.50
}
]
},
{
"resolution_limits": [2.40,2.30],
"number_observations": 17791,
"number_observations_unique": 4497,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.330
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Completeness",
"value": 97.50
}
]
},
{
"resolution_limits": [2.50,2.40],
"number_observations": 15153,
"number_observations_unique": 3837,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.268
},
{
"type": "I/SigI",
"value": 5.2
},
{
"type": "Completeness",
"value": 97.90
}
]
},
{
"resolution_limits": [2.60,2.50],
"number_observations": 12752,
"number_observations_unique": 3238,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.219
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 97.90
}
]
},
{
"resolution_limits": [2.70,2.60],
"number_observations": 10818,
"number_observations_unique": 2737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.177
},
{
"type": "I/SigI",
"value": 7.8
},
{
"type": "Completeness",
"value": 98.10
}
]
},
{
"resolution_limits": [2.80,2.70],
"number_observations": 9617,
"number_observations_unique": 2445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 98.10
}
]
},
{
"resolution_limits": [2.90,2.80],
"number_observations": 8161,
"number_observations_unique": 2084,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "I/SigI",
"value": 10.6
},
{
"type": "Completeness",
"value": 98.30
}
]
},
{
"resolution_limits": [3.00,2.90],
"number_observations": 7129,
"number_observations_unique": 1816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 12.5
},
{
"type": "Completeness",
"value": 98.40
}
]
},
{
"resolution_limits": [4.00,3.00],
"number_observations": 38458,
"number_observations_unique": 9875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 18.9
},
{
"type": "Completeness",
"value": 98.80
}
]
},
{
"resolution_limits": [5.00,4.00],
"number_observations": 13542,
"number_observations_unique": 3526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 25.5
},
{
"type": "Completeness",
"value": 99.10
}
]
},
{
"resolution_limits": [6.00,5.00],
"number_observations": 5875,
"number_observations_unique": 1539,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 25.5
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [10.00,6.00],
"number_observations": 6727,
"number_observations_unique": 1697,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 27.7
},
{
"type": "Completeness",
"value": 99.40
}
]
},
{
"resolution_limits": [100,10.00],
"number_observations": 1834,
"number_observations_unique": 466,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 32.0
},
{
"type": "Completeness",
"value": 98.90
}
]
}
]
}