Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e8d204e5681d494fa54ba4aec68ff164",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 57.303,
"b": 57.528,
"c": 92.364,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97828],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.853,1.40],
"number_observations_unique": 60504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 12.650
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 5.1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.45,1.40],
"number_observations": 14308,
"number_observations_unique": 5659,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.470
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 94.70
},
{
"type": "Redundancy",
"value": 2.53
}
]
},
{
"resolution_limits": [1.51,1.45],
"number_observations": 21053,
"number_observations_unique": 6185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.358
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [1.58,1.51],
"number_observations": 21711,
"number_observations_unique": 6049,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.270
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [1.66,1.58],
"number_observations": 20675,
"number_observations_unique": 5754,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 99.80
}
]
},
{
"resolution_limits": [1.76,1.66],
"number_observations": 23371,
"number_observations_unique": 5842,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.174
},
{
"type": "I/SigI",
"value": 6.8
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [1.90,1.76],
"number_observations": 32785,
"number_observations_unique": 6240,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [2.09,1.90],
"number_observations": 40244,
"number_observations_unique": 6038,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 15.2
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [2.39,2.09],
"number_observations": 43914,
"number_observations_unique": 6103,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 20.9
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [3.01,2.39],
"number_observations": 44190,
"number_observations_unique": 6192,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 25.9
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [48.853,3.01],
"number_observations": 43721,
"number_observations_unique": 6443,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 31.3
},
{
"type": "Completeness",
"value": 99.80
}
]
}
]
}