Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2911e068dea1ec71f954697c2345ade1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 223.21,
"b": 67.61,
"c": 103.58,
"alpha": 90.00,
"beta": 108.39,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.000,3.000],
"number_observations_unique": 26685,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 24.500
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 3.400
}
]
},
"refln_shells": [
{
"resolution_limits": [3.11,3.00],
"number_observations_unique": 2168,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.287
},
{
"type": "Completeness",
"value": 73.40
},
{
"type": "Redundancy",
"value": 2.20
}
]
},
{
"resolution_limits": [3.23,3.11],
"number_observations_unique": 2454,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.248
},
{
"type": "Completeness",
"value": 84.00
},
{
"type": "Redundancy",
"value": 2.60
}
]
},
{
"resolution_limits": [3.38,3.23],
"number_observations_unique": 2578,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "Completeness",
"value": 88.20
},
{
"type": "Redundancy",
"value": 2.90
}
]
},
{
"resolution_limits": [3.56,3.38],
"number_observations_unique": 2663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "Completeness",
"value": 90.40
},
{
"type": "Redundancy",
"value": 3.10
}
]
},
{
"resolution_limits": [3.78,3.56],
"number_observations_unique": 2692,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "Completeness",
"value": 91.20
},
{
"type": "Redundancy",
"value": 3.30
}
]
},
{
"resolution_limits": [4.07,3.78],
"number_observations_unique": 2733,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.07
},
{
"type": "Completeness",
"value": 92.90
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [4.48,4.07],
"number_observations_unique": 2857,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "Completeness",
"value": 96.10
},
{
"type": "Redundancy",
"value": 3.70
}
]
},
{
"resolution_limits": [5.13,4.48],
"number_observations_unique": 2889,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 4.00
}
]
},
{
"resolution_limits": [6.46,5.13],
"number_observations_unique": 2940,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "Completeness",
"value": 98.30
},
{
"type": "Redundancy",
"value": 4.20
}
]
},
{
"resolution_limits": [40.00,6.46],
"number_observations_unique": 2711,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "Completeness",
"value": 88.30
},
{
"type": "Redundancy",
"value": 4.00
}
]
}
]
}