Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7ed85ed2453d0716d8d176ff2bc90532",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 89.377,
"b": 87.314,
"c": 63.051,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [2.90000,3.90000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.653,2.181],
"number_observations_unique": 8512,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 67.200
},
{
"type": "Redundancy",
"value": 6.200
}
]
},
"refln_shells": [
{
"resolution_limits": [2.32,2.20],
"number_observations": 3484,
"number_observations_unique": 861,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.314
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 46.90
},
{
"type": "Redundancy",
"value": 4.00
}
]
},
{
"resolution_limits": [2.46,2.32],
"number_observations": 3743,
"number_observations_unique": 862,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.313
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 50.10
},
{
"type": "Redundancy",
"value": 4.30
}
]
},
{
"resolution_limits": [2.63,2.46],
"number_observations": 3740,
"number_observations_unique": 855,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.292
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 52.40
},
{
"type": "Redundancy",
"value": 4.40
}
]
},
{
"resolution_limits": [2.84,2.63],
"number_observations": 4184,
"number_observations_unique": 887,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.289
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 59.00
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [3.11,2.84],
"number_observations": 5226,
"number_observations_unique": 956,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.259
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 69.50
},
{
"type": "Redundancy",
"value": 5.50
}
]
},
{
"resolution_limits": [3.48,3.11],
"number_observations": 7080,
"number_observations_unique": 1032,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.241
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 81.00
},
{
"type": "Redundancy",
"value": 6.90
}
]
},
{
"resolution_limits": [4.02,3.48],
"number_observations": 8598,
"number_observations_unique": 1005,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.223
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 90.10
},
{
"type": "Redundancy",
"value": 8.60
}
]
},
{
"resolution_limits": [4.92,4.02],
"number_observations": 8725,
"number_observations_unique": 909,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.197
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 94.30
},
{
"type": "Redundancy",
"value": 9.60
}
]
},
{
"resolution_limits": [6.96,4.92],
"number_observations": 5832,
"number_observations_unique": 729,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 96.10
},
{
"type": "Redundancy",
"value": 8.00
}
]
},
{
"resolution_limits": [33.65,6.96],
"number_observations": 2147,
"number_observations_unique": 416,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "I/SigI",
"value": 4.5
},
{
"type": "Completeness",
"value": 94.30
},
{
"type": "Redundancy",
"value": 5.20
}
]
}
]
}