Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6355fae0e2429af56da4325f711517b1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.401,
"b": 65.190,
"c": 59.730,
"alpha": 90.0,
"beta": 128.6,
"gamma": 90.0
},
"wavelengths": [0.97883,0.91837],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.531,1.22],
"number_observations_unique": 71683,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 10.240
},
{
"type": "Completeness",
"value": 98.600
}
]
},
"refln_shells": [
{
"resolution_limits": [1.26,1.22],
"number_observations": 22928,
"number_observations_unique": 6473,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.658
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 97.20
}
]
},
{
"resolution_limits": [1.31,1.26],
"number_observations": 25656,
"number_observations_unique": 7062,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.581
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 97.50
}
]
},
{
"resolution_limits": [1.37,1.31],
"number_observations": 26277,
"number_observations_unique": 7186,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.479
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 97.90
}
]
},
{
"resolution_limits": [1.45,1.37],
"number_observations": 28955,
"number_observations_unique": 7890,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.361
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 98.10
}
]
},
{
"resolution_limits": [1.54,1.45],
"number_observations": 28709,
"number_observations_unique": 7034,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.270
},
{
"type": "I/SigI",
"value": 4.7
},
{
"type": "Completeness",
"value": 98.80
}
]
},
{
"resolution_limits": [1.66,1.54],
"number_observations": 38913,
"number_observations_unique": 7185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.206
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 98.90
}
]
},
{
"resolution_limits": [1.82,1.66],
"number_observations": 47842,
"number_observations_unique": 6877,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.159
},
{
"type": "I/SigI",
"value": 10.6
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [2.09,1.82],
"number_observations": 55059,
"number_observations_unique": 7426,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 16.8
},
{
"type": "Completeness",
"value": 99.30
}
]
},
{
"resolution_limits": [2.63,2.09],
"number_observations": 53189,
"number_observations_unique": 7184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 22.6
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [45.531,2.63],
"number_observations": 53509,
"number_observations_unique": 7353,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 29.8
},
{
"type": "Completeness",
"value": 99.10
}
]
}
]
}